SAINT V8.40A saint z7A9pa.slm /BATCH /CONFIG:z7A9pa.ini /NOPROMPT /PLAIN /PRIORITY:4 /SOCKET:& 2000 /THREADS:1 !==================================================== !10/26/2021 10:23:21 INTEGRATE & "/smb/isengard/data/neal054/fastscan_01_0001.sfrm,neal054_[1-23]_0001" & "/smb/isengard/data/neal054/work/neal054_01.raw,neal054_01A,neal054_[2-23]" & /2THETA=-9999.0000 /ACTTHRESH=0.0000 /ALPHA12 /AMNAME=$NEW /BATCH=1 & /BGCSCALE=0 /BGQSCALE=1 /BGSIG=1.000 /CHI=-9999.0000 /CRYSTAL=1 & /CYCLIM=25 /DAAP=0.0000 /DAPHI=0.00000 /DFRAME /ESDSCALE=1.00000 & /EXPOSURE=0.000 /GLOBAL /GMARQ=2.000000e-03 /GMIN=0 /GREFLIM=9999 & /GRLVERR=0.0250 /GSVD=1.000000e-06 /IAXIS=-9999 /IOVSIGMA=-3.00000 & /K1=3 /K2=3 /L1=T /L2=0 /LATTICE=0 /LMARQ=2.000000e-03 /LMIN=0 & /LORENTZ=0.02000 /LORMODEL=0.07500 /LRES=9999.00000 /LSFIT /LSFREQ=50 & /LSVD=5.000000e-05 /LTHR=8.000 /LWT=0.000 /MACHINE_ERROR=0.0000 & /MAXSATIND=1 /MCREFLIM=4096 /MCVERB=1 /MEDMSK=-1 /MISSING=0.6000 & /MMIC=20.00000 /NEXP=-9999 & /NFRAMES="180,80,94,80,80,94,82,92,82,92,92,80,92,82,82,92,94,95,82,92,95,95,360,126" & /NODECAY /NSIM=0 /OMEGA=-9999.0000 & /ORIENTATION="/smb/isengard/data/neal054/work/z7A9pa.p4p" & /ORTUPDSCALE=1.000 /OVRTIME=-9999.00000 /PHI=-9999.0000 & /POINTGROUP="2/m" /PROFXHALF=4 /PROFYHALF=4 /PROFZHALF=4 /QUEUEHALF=7 & /RESOLUTION="0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86,0.86" & /ROLL=0.000 /SEED=0 /SHRMSK=-1 /SMAP=$P4P /SMIC=20.00000 /SNAP=100 & /SPATIAL=$NULL /SSBIAS=1.0000 /STRONG=10.000 /TIMEOUT=0.000 & /TITLE="Integration of neal054" /TOPFILT /TPROF=0.0500 /TTM=0.000 & /TWINBOXRATIO=1.30000 /TWINMINCOMVOL=0.04000 /TWINSEPARATION=1.00000 & /VERBOSITY=2 /VOLANGSTROMS=1.00000 /VOLTARGET=1.00000 & /WIDTH=-9999.0000 /WTMETH=2 /XSIZE=0.7800 /YSIZE=0.7800 /ZSIZE=2.2700 & /ZW=1.000 Multiple runs have been specified: (current run indicated with "*") FRAME MATRIX OUTPUT #FRAMES RESOLUTIONS fastscan_01_0001.sfrm z7A9pa.p4p neal054_01.raw 180 0.86 neal054_01_0001.sfrm z7A9pa.p4p neal054_01A.raw 80 0.86 neal054_02_0001.sfrm z7A9pa.p4p neal054_02.raw 94 0.86 neal054_03_0001.sfrm z7A9pa.p4p neal054_03.raw 80 0.86 neal054_04_0001.sfrm z7A9pa.p4p neal054_04.raw 80 0.86 neal054_05_0001.sfrm z7A9pa.p4p neal054_05.raw 94 0.86 *neal054_06_0001.sfrm z7A9pa.p4p neal054_06.raw 82 0.86 neal054_07_0001.sfrm z7A9pa.p4p neal054_07.raw 92 0.86 neal054_08_0001.sfrm z7A9pa.p4p neal054_08.raw 82 0.86 neal054_09_0001.sfrm z7A9pa.p4p neal054_09.raw 92 0.86 neal054_10_0001.sfrm z7A9pa.p4p neal054_10.raw 92 0.86 neal054_11_0001.sfrm z7A9pa.p4p neal054_11.raw 80 0.86 neal054_12_0001.sfrm z7A9pa.p4p neal054_12.raw 92 0.86 neal054_13_0001.sfrm z7A9pa.p4p neal054_13.raw 82 0.86 neal054_14_0001.sfrm z7A9pa.p4p neal054_14.raw 82 0.86 neal054_15_0001.sfrm z7A9pa.p4p neal054_15.raw 92 0.86 neal054_16_0001.sfrm z7A9pa.p4p neal054_16.raw 94 0.86 neal054_17_0001.sfrm z7A9pa.p4p neal054_17.raw 95 0.86 neal054_18_0001.sfrm z7A9pa.p4p neal054_18.raw 82 0.86 neal054_19_0001.sfrm z7A9pa.p4p neal054_19.raw 92 0.86 neal054_20_0001.sfrm z7A9pa.p4p neal054_20.raw 95 0.86 neal054_21_0001.sfrm z7A9pa.p4p neal054_21.raw 95 0.86 neal054_22_0001.sfrm z7A9pa.p4p neal054_22.raw 360 0.86 neal054_23_0001.sfrm z7A9pa.p4p neal054_23.raw 126 0.86 Current batch number is 7 Integration of neal054 Logical CPUs detected: 12 Number of threads to be used: 1 Additional read-ahead threads: 0 Input linear pixel scale: 1.00000 Input frame rows, columns: 1024 1536 Frame queue half-size: 7 Number of frames in queue: 15 Profile X,Y,Z half-widths: 4 4 4 Number of X,Y,Z profile points: 9 9 9 Fraction-of-maximum method will be used to determine summation volume SMART CCD DETECTOR PARAMETERS ------------ Detector type = 1 was obtained from CONFIGURE menu Multiwire reference correction will be disabled Detector is a single tile (from CONFIGURE menu) Read noise (e-): 45.56 (from frame neal054_06_0001.sfrm) Electrons per A/D unit: 36.60 (from frame neal054_06_0001.sfrm) Electrons per x-ray photon: 213.90 (from frame neal054_06_0001.sfrm) Base offset per exposure: 64 (from frame neal054_06_0001.sfrm) Per-exposure full scale: 163809 (from frame neal054_06_0001.sfrm) Nominal pixels per CM: 36.955 (from CONFIGURE menu) CM from face to imaging plane: 1.004 (from CONFIGURE menu) Fiducial spot spacing(CM): 0.425 (from CONFIGURE menu) Faceplate transmittance: 0.8192 (from CONFIGURE menu) Phosphor absorption: 1.0000 (from CONFIGURE menu) Air absorption (per CM): 0.0106 (from CONFIGURE menu) Active pixel threshold: 0.000 (from Advanced menu) Frames were acquired with BIS V6.2.15/2021-03-15 && APEX3 2019.11-0 Booster system: rescan threshold is 60,000 ADU Starting swing angle will be obtained from frame header Starting omega will be obtained from frame header Starting phi will be obtained from frame header Starting chi will be obtained from frame header Number of exposures summed will be obtained from frame header Scan axis will be obtained from frame header Scan width will be obtained from frame header Exposure time will be obtained from frame header Initial background ================== 10/26/2021 10:23:21 Initial background range (deg) = 10.00, interleave = 2 Number of BG pixels >= 64K: 0 Initial BG frame written to neal054_ib_06_0001.sfrm Nominal time per frame (s): 21 Intensity normalization in deg/min: 2.85714 Output intensities are multiplied by this value to place on scale of 1 min/deg Reading orientation and spatial calibration ========== 10/26/2021 10:23:22 INFO: No spatial correction will be used Orientation for 1 component read from /smb/isengard/data/neal054/work/z7A9pa.p4p Detector distance of 3.996 cm was obtained from header of /smb/isengard/data/neal054/neal054_06_0001.sfrm Component numbers S.C(F) below: S=sample, C=component in sample, F=component in file ... Input P4P data for sample 1 of 1: ... This sample is a single crystal with 3 indices (HKL) ... Component 1.1(1) (component 1 in sample 1, 1 of 1 in file) Orientation ("UB") matrix: 0.1439016 0.0358145 -0.0041686 0.0307886 -0.0026042 0.0770831 0.0657271 -0.0771916 -0.0045347 Unit Cell: A B C Alpha Beta Gamma 6.2486 11.7460 13.0234 90.000 96.799 90.000 Detector corrections: X-Cen Y-Cen Dist Pitch Roll Yaw -3.618 -0.211 0.081 -0.198 -0.180 0.551 Goniometer zeros (deg): 0.0000 0.0000 0.0000 0.0000 Crystal translations (pixels): 0.0000 0.0000 0.0000 ... End component 1.1(1) ... End sample 1 of 1 Mean, a1, a2 wavelength (Angstroms): 1.54184 1.54056 1.54439 Alpha1:alpha2 ratio: 2.00000 Nominal detector distance (cm): 3.996 X,Y beam center @swing=0 (pixels): 773.94 507.14 Input sample map: 1 Input components will be treated as follows: Component Lattice PointGroup Wanted Indices Subsystems 1.1(1) 0=P 2/m(B-unique) Y 3=HKL 1 Active pixel mask ================== 10/26/2021 10:23:22 Median filter size: input, used -1, 4 Mask shrinkage (pix): input, used -1, 6 No diamond-anvil cell occlusions will be computed Active area will be limited according to x-ray aperture file: neal054_xa_06_0001.sfrm Active pixel mask written to neal054_am_06_0001.sfrm Fraction of mask marked active: 0.9595 Scan axis is OMEGA Spatially corrected beam center: 773.94 507.14 Direction cosines of rotation axis: 0.004 0.000 1.000 Starting frame angles (degrees): 58.943 57.368 306.000 315.500 Vertical tilt of beam (degrees): 0.2200 Exposures per frame: 1 Output sigma(I)'s will be scaled by: 1.0000 Fraction of I to be combined with sigma(I)'s: 0.0000 Maximum number of frames to be processed: 82 Mark-up frames will not be written Narrow-frame algorithm will be used. Per-frame BG offsets will be used. Recurrence-method BG will be used. Direct beam monitor will not be used. Alpha1,2 splitting will be added to box sizes Box volumes will be multiplied by exp(0.00000 * [sin(theta)/lambda]^2 Target volume factor is 1.000 at 1.000 angstroms Max allowed missing profile intensity: 0.600 Lorentz cutoff for exclusion from output: 0.0200 Lorentz cutoff for exclusion from model profiles: 0.0750 LS will use individual reflection weights Initial orientation and spot-shape refinement ============== 10/26/2021 10:23:23 Input X,Y,Z spot size (deg): 0.780 0.780 2.270 Scale for orientation update length: 1.00000 #Frames running average for orientation update: 14 Frames between full refinements of orientation: 50 Frames in BG running avg (correlation length): 16 Nominal frame width in degrees: 1.000 Accurate-timing indicator is set in the frame headers: Velocity normalization will be computed for each frame Pixel spacing (deg): 0.129 Profile X,Y,Z spacing (deg): 0.109 0.090 0.328 Profile convolver halfwidth: 1.00 1.00 1.79 Background pixels updated = 92.88% Port, connections: 2000, 1 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 0_0001 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 17 0.78 0.78 2.27 1.000 1_0002 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 16 0.78 0.78 2.27 1.000 2_0003 4 0.15 0.10 -0.01 0.37 0.19 0.10 15355 28 0 0.45 24 0.78 0.78 2.27 1.000 3_0004 7 0.43 0.62 -0.17 0.80 0.88 0.22 38711 36 14 0.39 29 0.78 0.78 2.27 1.000 4_0005 10 0.50 0.20 -0.06 1.00 0.43 0.47 101966 86 0 0.53 30 0.78 0.78 2.27 1.000 5_0006 11 0.06 0.03 0.05 0.35 0.22 0.17 28743 40 0 0.63 27 0.78 0.78 2.27 1.000 6_0007 8 0.21 0.25 -0.04 0.73 0.76 0.23 74834 80 0 0.70 28 0.78 0.78 2.27 1.000 7_0008 14 0.25 0.18 -0.06 0.46 0.35 0.28 35875 38 0 0.71 27 0.78 0.78 2.27 1.000 8_0009 5 -0.06 -0.01 0.13 0.23 0.11 0.28 91637 90 0 0.77 32 0.78 0.78 2.27 1.000 9_0010 5 0.65 0.21 -0.01 1.57 0.36 0.27 44158 47 0 0.60 24 0.78 0.78 2.27 1.000 10_0011 12 0.18 0.09 0.06 0.41 0.44 0.12 58531 70 0 0.64 26 0.78 0.78 2.27 1.000 11_0012 10 0.46 0.02 -0.04 0.98 0.26 0.31 32148 42 10 0.70 27 0.78 0.78 2.27 1.000 12_0013 7 0.11 0.08 -0.02 0.27 0.21 0.12 28315 41 14 0.59 28 0.78 0.78 2.27 1.000 13_0014 11 0.05 0.02 0.06 0.17 0.18 0.19 59330 60 0 0.63 28 0.78 0.78 2.27 1.000 14_0015 10 0.23 0.13 -0.06 0.40 0.46 0.14 38827 46 0 0.71 30 0.78 0.78 2.27 1.000 15_0016 9 0.03 -0.09 0.06 0.29 0.15 0.10 68082 66 0 0.73 28 0.78 0.78 2.27 1.000 16_0017 4 -0.09 -0.10 0.11 0.25 0.15 0.19 32979 45 0 0.63 25 0.78 0.78 2.27 1.000 17_0018 16 0.01 -0.14 0.01 0.24 0.20 0.18 80252 86 0 0.65 29 0.78 0.78 2.27 1.000 18_0019 10 0.11 0.02 -0.06 0.31 0.21 0.34 78523 72 0 0.73 29 0.78 0.78 2.27 1.000 19_0020 7 0.00 -0.12 -0.07 0.31 0.17 0.22 54997 49 0 0.69 26 0.78 0.78 2.27 1.000 Background pixels updated = 92.48% Port, connections: 2000, 1 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 20_0021 9 -0.09 -0.12 0.10 0.38 0.16 0.17 63646 58 11 0.68 27 0.78 0.78 2.27 1.000 21_0022 5 0.24 -0.07 0.15 0.43 0.17 0.22 15418 31 0 0.72 24 0.78 0.78 2.27 1.000 22_0023 5 0.02 -0.14 0.06 0.24 0.15 0.15 59966 60 0 0.71 27 0.78 0.78 2.27 1.000 23_0024 10 0.10 -0.13 -0.12 0.49 0.24 0.73 48347 52 0 0.70 27 0.78 0.78 2.27 1.000 24_0025 10 -0.04 -0.12 0.05 0.14 0.14 0.23 155146 107 0 0.66 28 0.78 0.78 2.27 1.000 25_0026 9 0.02 -0.10 0.07 0.14 0.16 0.12 35801 43 0 0.73 27 0.78 0.78 2.27 1.000 26_0027 5 -0.05 -0.15 0.59 0.17 0.19 1.02 31699 47 0 0.81 23 0.78 0.78 2.27 1.000 27_0028 13 -0.37 -0.19 0.08 1.30 0.22 0.15 68914 66 8 0.73 30 0.78 0.78 2.27 1.000 I/Sigma = 62.47 Thresh = 0.020 Blend = F #Contributing = 53 InitialProfileWt = 0.041 Region 1 Sum = 19156.2; Maximum = 229.289; FM = 0.714 !Region 1: Section 1->3 0 1 0 0 0 0 0 0 0 5 14 4 1 0 0 0 0 0 14 33 12 6 3 2 1 0 0 1 1 1 0 0 0 0 0 0 6 12 9 5 2 1 1 1 0 23 47 43 28 15 6 3 1 0 1 1 0 0 0 0 0 0 0 7 13 9 5 2 1 1 1 0 25 52 46 32 16 6 3 1 0 0 1 0 0 0 0 0 0 0 5 10 9 6 3 1 1 1 0 26 55 54 39 22 9 4 1 0 0 0 0 0 0 0 0 0 0 3 5 4 3 1 1 1 1 0 15 31 30 23 15 7 3 1 1 0 0 0 0 0 0 0 0 0 2 3 4 2 1 1 1 0 0 11 23 25 20 13 5 2 1 0 0 0 0 0 0 0 0 0 0 1 2 2 1 1 0 1 0 0 7 14 15 12 7 3 1 1 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 3 7 7 6 4 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 1 1 1 0 0 0 !Region 1: Section 4->6 16 26 16 16 10 5 2 1 0 6 9 13 19 12 8 5 2 0 1 3 6 8 7 7 6 4 1 31 70 77 68 48 27 13 4 1 14 38 54 65 61 46 26 9 2 2 7 13 24 32 33 25 12 3 35 78 88 81 57 30 13 5 1 18 48 69 84 80 57 31 12 3 3 11 21 34 50 53 40 21 5 41 90100 91 70 40 19 7 1 20 52 74 90 94 76 47 20 4 3 11 22 39 59 67 55 30 7 25 60 73 73 60 37 18 7 2 15 42 67 87 89 72 45 22 4 3 11 23 40 58 67 59 36 10 19 45 58 58 47 28 14 6 1 11 32 52 66 70 59 41 21 4 2 8 18 31 47 59 56 36 11 12 28 35 35 29 19 11 5 1 7 19 31 41 44 40 30 17 3 1 5 11 18 29 40 41 29 8 6 15 20 21 19 11 6 3 1 4 12 20 27 28 25 19 11 3 1 3 7 12 18 27 31 24 8 2 3 3 4 5 4 3 1 0 1 2 3 5 8 9 7 5 1 0 1 1 3 5 8 9 9 3 !Region 1: Section 7->9 0 1 1 1 2 4 4 3 1 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 1 1 3 7 11 12 8 2 0 0 0 0 1 1 2 2 1 0 0 0 0 0 0 0 0 0 1 1 2 5 14 24 24 16 5 0 0 0 1 2 4 5 4 1 0 0 0 0 0 0 0 0 0 1 1 3 7 16 27 30 20 6 0 0 0 1 2 4 6 5 2 0 0 0 0 0 0 0 0 0 0 1 2 7 18 31 36 27 9 0 1 0 1 2 4 7 7 3 0 0 0 0 0 0 0 0 0 0 1 2 5 14 26 33 27 10 0 1 1 1 2 4 6 6 3 0 0 0 0 0 0 0 0 0 0 1 1 3 9 19 25 23 9 0 0 0 1 2 3 5 6 3 0 0 0 0 0 0 0 0 0 0 1 1 2 6 13 21 20 9 0 0 0 0 1 2 4 5 3 0 0 0 0 0 0 0 0 0 0 0 0 1 1 3 5 7 3 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 I/Sigma = 260.64 Thresh = 0.020 Blend = F #Contributing = 39 InitialProfileWt = 0.061 Region 2 Sum = 325849; Maximum = 4598.63; FM = 0.859 !Region 2: Section 1->3 0 0 0 0 0 0 0 0 0 0 1 1 4 5 9 3 1 0 0 1 5 16 18 23 8 2 0 0 0 0 0 0 0 0 0 0 0 1 3 8 11 10 5 2 0 0 2 10 30 43 37 18 6 2 0 0 0 0 0 0 0 0 0 0 1 3 10 15 16 9 3 1 0 3 13 41 59 59 35 13 3 0 0 0 0 0 0 0 0 0 0 0 2 7 12 14 9 3 1 0 2 11 31 49 58 40 15 3 0 0 0 0 0 0 0 0 0 0 0 2 7 11 12 7 2 0 0 2 8 28 47 52 33 10 2 0 0 0 0 0 0 0 0 0 0 0 1 3 6 8 4 1 0 0 1 4 14 32 38 18 4 1 0 0 0 0 0 0 0 0 0 0 0 0 2 4 4 1 0 0 0 0 2 8 18 19 7 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 1 2 6 5 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 !Region 2: Section 4->6 0 1 5 20 24 22 9 2 0 0 1 3 13 18 17 9 3 1 0 0 2 8 11 14 10 5 1 0 3 14 42 66 57 26 8 2 0 2 10 32 58 55 27 8 1 0 1 8 21 37 36 21 8 1 0 4 22 64 98 95 50 16 3 0 5 23 62100 97 50 16 3 1 5 19 46 70 68 41 18 4 0 6 26 62 91 98 61 20 3 1 9 33 72 98 95 53 16 3 1 9 27 54 67 59 33 13 3 0 4 23 60 86 91 56 17 3 1 9 36 77 97100 62 22 5 1 9 30 59 72 72 49 24 7 0 2 15 39 63 65 32 8 1 1 5 26 56 71 65 35 12 3 1 6 21 42 50 45 29 15 4 0 1 7 21 35 32 13 4 1 0 2 12 32 41 34 19 8 2 1 3 10 24 31 28 20 11 4 0 1 3 9 13 11 5 2 0 0 1 5 14 18 16 11 6 2 1 2 4 10 14 16 13 8 3 0 0 1 2 2 1 1 1 0 0 0 1 3 3 2 1 1 0 0 1 1 3 3 2 2 2 1 !Region 2: Section 7->9 0 0 1 4 4 5 5 3 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 10 13 11 7 3 1 0 0 1 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 2 9 19 26 23 15 8 2 0 0 1 3 3 2 1 1 0 0 0 0 0 0 0 0 0 0 1 4 12 22 25 20 11 6 2 0 0 1 3 3 2 1 1 0 0 0 0 0 0 0 0 0 0 1 4 11 22 26 25 18 10 3 0 0 1 2 3 2 2 1 0 0 0 0 0 0 0 0 0 0 1 3 8 15 19 17 13 8 3 0 0 1 2 2 2 2 1 0 0 0 0 0 0 0 0 0 0 1 1 4 9 12 12 10 6 2 0 0 1 1 2 2 2 1 0 0 0 0 0 0 0 0 0 0 0 1 2 4 5 7 7 5 2 0 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 2 1 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 105.73 Thresh = 0.020 Blend = F #Contributing = 31 InitialProfileWt = 0.079 Region 3 Sum = 58820.7; Maximum = 1017.16; FM = 0.76 !Region 3: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 1 2 4 5 3 2 1 1 3 5 13 20 19 11 5 2 0 0 0 0 0 0 0 0 0 0 1 1 4 9 11 9 5 2 1 5 13 27 44 50 34 16 4 0 0 0 0 0 0 0 0 0 0 0 1 4 8 10 7 4 1 1 4 13 30 48 49 32 13 3 0 0 0 0 0 0 0 0 0 0 0 1 3 6 7 5 2 1 0 3 9 22 36 38 25 9 2 0 0 0 0 0 0 0 0 0 0 0 0 2 4 5 3 1 0 0 1 5 14 26 26 16 6 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 2 1 0 0 1 3 8 15 15 9 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 1 4 7 6 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 !Region 3: Section 4->6 1 5 10 24 37 33 16 5 1 1 4 6 17 28 27 12 3 0 0 1 1 4 8 8 3 1 0 2 11 28 53 80 83 51 17 3 1 7 19 38 62 64 34 8 1 0 1 4 10 19 21 10 2 0 1 10 29 64 98 97 58 19 3 1 6 21 52 86 89 50 14 2 0 2 5 15 31 36 17 5 1 1 6 23 59 93 90 55 17 3 1 5 20 58100 99 56 16 2 0 2 6 22 44 46 23 6 1 1 3 15 44 75 71 40 13 2 0 3 16 52 90 85 46 13 2 0 1 7 24 47 46 24 6 1 0 2 9 29 54 50 27 9 2 0 2 11 39 76 72 37 11 2 0 1 7 22 48 49 24 7 1 0 1 4 15 30 28 14 5 1 0 1 6 24 48 46 24 8 1 0 1 5 17 34 34 19 7 1 0 1 2 7 15 12 6 2 1 0 1 4 12 27 25 13 4 1 0 1 4 10 21 23 14 5 1 0 0 1 2 4 4 2 1 0 0 0 1 4 8 9 6 2 0 0 1 2 4 8 10 9 4 0 !Region 3: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 4 6 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 8 9 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 5 11 12 6 2 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 6 15 17 8 3 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 6 12 13 8 3 1 0 0 0 1 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 1 2 4 9 11 8 4 1 0 0 0 1 2 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 4 6 5 3 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 64.90 Thresh = 0.020 Blend = F #Contributing = 12 InitialProfileWt = 0.301 Region 4 Sum = 15714.7; Maximum = 280.878; FM = 0.763 !Region 4: Section 1->3 0 0 0 0 0 0 0 0 0 3 7 5 2 1 0 0 0 0 8 22 13 8 4 1 0 0 0 0 1 0 0 0 0 0 0 0 5 10 8 4 2 1 0 0 0 15 33 28 16 7 2 1 0 0 0 0 0 0 0 1 0 0 0 4 8 7 4 2 1 1 0 0 12 28 27 15 7 2 1 0 0 0 0 0 0 0 0 0 0 0 2 5 5 3 2 1 1 1 1 7 21 20 13 7 3 1 1 1 0 0 0 0 0 0 0 0 0 1 3 3 2 1 1 0 1 0 3 12 13 11 6 2 1 1 0 0 0 0 0 0 0 0 0 0 0 1 2 1 1 1 0 0 0 1 5 7 6 4 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 1 2 3 3 3 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 1 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 !Region 4: Section 4->6 9 25 16 15 11 3 0 0 0 4 16 12 19 18 6 1 1 0 1 5 4 9 9 3 1 0 0 16 44 53 40 23 9 3 1 0 8 32 63 58 40 20 6 2 1 2 10 27 29 21 11 3 1 0 14 43 59 50 31 15 6 2 0 9 37 75 82 61 34 13 4 1 3 13 33 43 35 19 7 2 1 11 39 54 55 40 21 9 3 1 8 37 76100 82 47 20 6 1 3 14 35 55 48 28 12 4 1 6 26 42 51 43 23 11 4 1 6 29 64 96 95 57 27 9 2 2 11 31 56 59 38 18 6 1 3 14 28 40 38 23 12 5 1 3 17 47 83 88 59 31 12 2 2 7 24 51 58 42 23 9 2 1 7 16 26 28 19 11 4 1 2 9 30 57 67 53 30 12 3 1 4 17 37 47 40 24 9 2 1 3 9 16 17 13 9 3 1 1 5 17 35 44 37 25 10 2 0 3 10 23 33 31 21 9 2 0 1 3 5 5 3 3 1 0 0 1 5 12 14 10 9 4 1 0 1 3 9 12 10 8 4 1 !Region 4: Section 7->9 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 4 4 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 6 6 4 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 7 9 6 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 8 10 8 5 2 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 1 2 6 9 10 6 3 1 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 4 8 9 7 4 1 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 2 3 4 3 2 1 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 33.50 Thresh = 0.020 Blend = F #Contributing = 8 InitialProfileWt = 0.393 Region 5 Sum = 6250.29; Maximum = 90.8002; FM = 0.559 !Region 5: Section 1->3 0 0 0 0 0 1 0 0 0 1 1 1 0 1 1 0 0 0 2 9 8 2 1 0 0 1 0 0 0 0 0 1 1 0 0 0 3 3 1 0 1 1 0 1 1 17 26 17 9 4 1 0 1 1 1 0 0 0 0 0 0 0 1 3 4 2 0 1 0 0 1 1 20 33 23 13 8 2 0 0 1 0 0 0 0 0 0 0 1 0 2 3 2 1 0 0 0 1 1 18 32 25 17 10 4 1 0 1 0 0 0 1 0 0 0 1 0 2 2 2 1 1 0 1 2 0 15 29 26 17 14 6 2 2 0 1 0 0 0 1 -1 0 0 0 3 3 2 0 1 -1 0 0 0 12 23 20 14 13 6 2 1 1 0 0 0 0 0 0 -1 0 0 2 1 1 1 -1 -1 -1 0 -1 7 14 12 10 9 5 1 1 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 3 7 5 5 6 5 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 2 2 1 2 1 1 1 0 !Region 5: Section 4->6 4 24 25 10 4 1 1 1 1 4 20 23 11 4 2 1 0 1 1 5 6 5 2 1 1 1 1 41 68 56 31 12 4 1 0 0 33 57 53 33 14 6 3 0 1 7 14 16 13 8 5 3 2 1 52 94 72 47 25 7 3 0 1 43 82 68 52 30 10 5 1 1 8 18 20 23 17 7 5 3 1 49100 84 60 37 15 4 2 1 43 90 81 69 47 21 9 4 1 9 21 24 32 26 15 11 6 1 43 97 89 62 51 26 8 3 1 39 90 89 75 65 37 16 8 2 9 23 29 38 38 28 21 13 3 31 72 73 57 52 29 10 4 1 28 71 78 71 69 47 23 9 3 7 20 29 38 44 38 30 16 4 17 45 49 39 39 25 10 4 2 18 47 56 53 58 44 24 12 4 6 15 23 31 40 37 31 22 6 7 23 26 21 27 21 10 4 1 7 25 33 32 43 38 23 10 4 3 9 14 21 30 32 30 21 7 1 5 7 6 9 7 4 2 0 1 6 10 11 17 15 11 4 2 1 3 5 7 13 15 15 9 4 !Region 5: Section 7->9 0 1 1 1 1 1 1 1 1 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 2 3 3 2 3 2 2 1 0 1 0 0 0 0 1 1 0 -1 0 0 -1 0 0 0 0 0 0 3 4 6 5 4 3 2 1 0 1 0 0 0 1 1 1 0 -1 0 -1 -1 0 0 0 0 0 1 3 5 9 8 7 7 5 1 0 0 1 2 2 1 2 1 0 0 0 0 1 0 -1 0 0 0 1 3 6 11 12 12 13 10 2 0 1 1 2 1 2 3 3 1 0 0 0 0 0 0 0 0 0 1 3 7 11 15 17 21 14 3 0 0 1 1 3 3 6 5 1 0 0 0 0 1 0 0 0 0 0 2 6 9 13 17 22 20 5 0 0 1 0 1 3 6 7 2 0 -1 0 -1 0 0 0 0 0 1 1 3 6 10 13 22 21 6 0 1 0 1 1 2 6 6 2 0 1 0 0 0 0 0 -1 0 0 1 1 2 4 7 10 8 3 0 0 0 0 1 1 2 3 1 0 0 0 0 0 0 0 0 0 I/Sigma = 36.61 Thresh = 0.020 Blend = F #Contributing = 6 InitialProfileWt = 0.513 Region 6 Sum = 4583.92; Maximum = 63.3374; FM = 0.464 !Region 6: Section 1->3 0 0 0 0 0 0 1 0 0 0 -1 0 0 0 0 1 0 0 3 1 2 2 1 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 1 0 1 0 0 8 10 8 6 3 1 1 1 0 0 1 1 1 1 1 0 0 -1 1 1 1 1 1 1 0 0 0 13 18 15 10 5 2 1 1 1 1 1 1 1 1 1 0 0 0 2 2 1 1 2 1 0 0 0 19 26 21 16 11 4 1 1 1 1 0 0 1 1 1 1 0 0 2 1 1 1 1 1 2 1 0 23 33 26 20 14 7 4 1 0 0 1 1 1 0 1 1 0 1 2 3 2 1 1 2 1 1 1 22 35 27 24 16 9 4 1 1 0 0 2 1 0 1 0 0 0 1 2 3 1 1 1 1 1 0 18 31 25 22 13 8 3 2 1 0 1 2 1 1 1 0 0 0 1 2 3 1 1 2 0 1 0 13 23 18 15 10 7 3 1 1 0 0 1 1 0 1 1 0 0 1 1 1 1 0 1 1 0 0 4 6 7 7 3 1 2 0 0 !Region 6: Section 4->6 10 6 6 6 3 2 0 0 0 8 6 6 6 2 2 0 0 0 2 2 3 2 1 2 2 1 0 27 33 27 19 8 4 3 2 1 23 29 24 18 8 5 3 2 1 5 7 8 7 5 4 4 4 1 42 53 46 34 16 5 2 2 2 35 45 41 32 16 7 4 2 2 7 11 12 12 10 8 6 4 2 62 79 66 52 32 11 4 2 2 51 65 58 50 32 14 7 3 2 9 14 17 20 17 12 11 9 4 69 99 79 64 45 21 10 4 2 56 80 69 62 48 26 13 7 3 11 17 21 27 26 22 20 19 9 64100 82 73 52 28 10 4 2 51 80 73 70 55 33 16 8 3 9 17 24 30 32 30 31 26 10 53 89 74 65 44 25 8 3 2 43 71 67 63 50 33 17 10 4 8 15 23 29 33 30 35 30 13 36 61 52 44 32 20 9 4 2 27 47 46 45 38 27 18 10 4 5 10 16 24 26 25 30 27 14 9 13 20 21 9 4 4 2 0 6 9 18 21 11 7 8 5 1 1 2 7 11 8 8 12 12 5 !Region 6: Section 7->9 1 1 1 1 1 1 2 1 1 0 0 1 1 0 0 1 1 1 0 0 0 0 0 0 0 0 0 1 2 3 3 3 3 5 4 2 0 0 1 1 1 1 2 1 1 0 0 0 0 0 0 0 0 0 2 3 3 4 6 6 7 6 3 1 1 1 1 2 2 3 3 1 0 0 0 0 0 0 0 0 0 2 3 5 7 8 8 12 14 8 1 1 1 1 2 2 5 6 4 0 0 0 0 0 0 0 0 0 3 5 7 10 13 17 23 30 17 2 1 2 2 3 5 8 13 8 0 0 0 0 0 0 0 0 0 2 5 9 11 16 25 37 41 18 1 1 2 2 4 8 14 18 8 0 0 0 0 0 0 0 0 0 1 3 8 11 17 23 41 42 19 0 1 2 2 4 7 15 18 8 0 0 0 1 1 1 0 0 -1 1 4 5 9 12 16 29 37 21 0 1 1 1 2 4 10 16 9 0 0 0 0 0 0 0 -1 -1 0 1 3 5 4 5 12 16 9 0 0 0 1 0 1 5 7 4 0 0 0 0 0 0 0 0 0 I/Sigma = 40.62 Thresh = 0.020 Blend = F #Contributing = 12 InitialProfileWt = 0.263 Region 7 Sum = 8567.21; Maximum = 121.703; FM = 0.605 !Region 7: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 0 0 1 3 3 3 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 3 6 6 5 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 -1 0 0 0 -1 -1 0 5 10 8 8 5 2 1 0 0 0 0 0 0 0 0 -1 0 0 1 1 0 1 0 0 -1 0 0 7 15 12 11 7 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 1 0 0 7 17 16 12 8 4 2 1 0 0 0 0 0 0 1 0 0 0 0 0 1 1 0 1 0 0 0 8 18 14 12 8 4 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 16 13 9 6 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 7 6 4 3 1 0 0 0 !Region 7: Section 4->6 2 5 4 5 4 3 2 1 0 3 6 7 8 6 6 3 2 1 1 2 3 3 3 3 3 2 1 6 15 18 18 14 9 6 3 1 7 18 25 27 22 16 12 7 3 2 5 9 11 10 9 9 8 4 12 30 33 33 28 16 12 6 1 13 35 46 49 43 27 24 14 4 3 11 17 20 19 16 19 18 8 20 47 48 49 38 22 14 8 2 21 56 68 73 58 37 28 18 6 6 17 25 29 25 23 26 24 12 28 64 67 64 45 27 15 8 3 30 73 91 93 68 45 30 17 6 8 22 33 36 30 28 31 27 12 31 75 77 67 48 28 16 7 1 34 86100 93 70 48 31 15 4 10 27 35 36 32 30 32 28 11 30 76 71 60 44 25 14 5 1 31 84 91 81 62 42 27 12 4 9 25 32 33 29 27 30 24 9 24 65 59 44 33 18 9 3 1 24 70 70 57 44 29 16 6 2 6 20 24 23 20 21 20 15 6 7 26 26 17 13 6 3 1 0 8 27 31 22 18 11 6 2 1 2 8 11 9 8 7 7 5 2 !Region 7: Section 7->9 0 0 1 1 1 1 2 2 1 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 3 6 8 4 0 0 1 1 2 1 3 4 2 0 0 0 0 0 0 0 0 0 0 0 1 3 4 8 12 19 10 0 0 0 1 2 3 4 8 5 0 0 0 0 0 0 0 0 0 0 1 2 3 5 12 21 28 15 0 0 0 1 2 5 8 12 7 0 0 0 0 0 1 0 1 0 1 1 2 4 7 15 28 34 16 0 1 1 1 2 5 11 15 7 0 0 0 0 0 0 1 1 1 1 3 3 5 7 15 30 37 16 0 1 2 2 2 5 11 17 7 0 0 0 0 0 0 0 1 1 1 2 3 6 8 15 29 32 13 0 1 1 2 3 5 11 14 5 0 1 0 0 1 0 0 1 0 0 1 2 5 6 13 21 21 9 0 0 0 1 2 4 8 9 4 0 0 0 0 0 0 0 0 0 0 1 1 2 2 4 8 7 3 0 0 0 0 1 1 3 3 1 0 0 0 0 0 0 0 0 0 I/Sigma = 71.57 Thresh = 0.020 Blend = F #Contributing = 9 InitialProfileWt = 0.301 Region 8 Sum = 21700.4; Maximum = 305.736; FM = 0.73 !Region 8: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 1 0 1 0 1 3 3 3 3 2 1 1 0 0 0 0 0 0 0 0 0 0 1 2 1 1 1 0 0 0 0 3 7 8 7 4 2 1 1 0 0 0 0 0 0 0 0 0 0 2 3 3 2 1 0 0 1 0 8 17 18 13 7 3 1 1 1 0 0 0 0 0 0 0 0 0 3 5 5 3 1 1 0 0 0 14 26 27 18 9 4 1 1 1 0 0 0 0 0 0 0 0 0 4 6 5 3 1 1 0 0 0 18 31 30 19 10 4 1 1 1 0 0 0 0 0 0 0 0 0 5 6 4 3 1 1 0 0 0 19 30 27 18 9 4 1 1 1 0 0 0 0 0 0 0 0 0 3 4 4 2 1 0 0 0 0 13 23 20 13 6 2 1 1 0 0 0 0 0 0 0 0 0 0 1 2 1 1 1 0 0 0 0 5 8 6 4 2 1 0 0 0 !Region 8: Section 4->6 1 1 2 4 6 5 5 2 0 1 1 4 12 20 22 27 12 3 0 1 3 11 22 27 36 17 6 2 4 8 14 19 16 11 5 1 1 4 12 33 65 68 53 30 9 1 3 9 29 68 81 71 44 14 4 11 16 23 25 20 12 6 2 2 9 22 50 81 83 61 34 11 1 4 15 42 85 99 81 49 18 10 25 31 33 30 21 13 5 2 4 16 32 62 89 85 62 30 10 2 7 20 50 92100 80 44 16 16 34 41 39 32 19 11 5 2 6 19 38 66 86 74 50 25 8 1 8 23 53 87 85 62 35 12 19 39 45 40 29 17 9 4 1 6 19 38 63 70 58 38 17 5 1 7 22 50 69 65 45 23 8 19 36 39 34 23 13 6 3 1 6 17 32 49 51 42 25 10 3 1 7 19 38 49 45 29 14 4 14 28 28 24 15 8 4 2 1 4 13 23 33 32 25 14 6 2 1 5 14 26 30 26 16 7 2 5 9 9 7 5 3 1 1 0 1 4 8 12 11 8 4 2 1 0 2 5 10 10 8 4 2 1 !Region 8: Section 7->9 0 0 1 3 7 9 13 8 3 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 1 2 6 19 26 26 19 7 0 0 0 0 0 1 1 2 1 0 0 0 0 0 0 0 1 0 0 1 3 9 24 32 31 21 9 0 0 0 0 1 1 2 2 1 0 0 0 0 0 0 1 1 0 0 1 4 11 26 32 29 19 8 0 0 1 0 1 1 2 3 2 0 0 0 0 0 0 1 1 0 1 2 4 11 24 27 22 15 6 0 1 0 0 1 1 1 2 1 0 0 0 0 0 0 0 1 1 0 2 5 11 19 20 15 9 4 0 1 1 0 0 0 1 1 1 0 0 0 0 0 0 0 1 0 1 2 4 8 13 13 9 6 2 0 0 1 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 1 3 5 8 7 5 3 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 137.75 Thresh = 0.020 Blend = F #Contributing = 33 InitialProfileWt = 0.090 Region 9 Sum = 81884.2; Maximum = 1463.86; FM = 0.817 !Region 9: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 2 1 1 0 0 0 2 5 10 15 13 6 2 1 0 0 0 0 0 0 0 0 0 0 1 2 2 3 2 1 0 0 0 3 6 12 20 18 10 3 1 0 0 0 0 0 0 0 0 0 0 1 3 4 4 4 2 1 0 0 3 10 20 31 30 17 6 1 0 0 0 0 0 0 0 0 0 0 1 3 3 4 4 2 1 0 0 4 10 16 24 25 15 6 1 0 0 0 0 0 0 0 0 0 0 1 2 2 3 3 2 1 0 0 2 6 11 17 18 12 5 1 0 0 0 0 0 0 0 0 0 0 0 1 2 2 2 1 1 0 0 1 4 9 13 14 8 4 1 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 0 0 0 1 2 4 6 6 4 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 1 1 0 0 !Region 9: Section 4->6 0 0 3 9 10 8 3 1 0 0 1 6 19 23 21 10 3 1 0 1 6 16 21 23 14 6 2 2 8 24 45 43 25 9 3 1 1 6 28 63 68 48 22 7 1 1 4 19 43 54 49 29 11 3 3 10 31 57 58 37 14 4 1 1 10 40 78 87 66 31 11 2 1 7 25 51 63 58 36 17 4 4 17 44 74 77 51 20 5 1 2 14 45 85100 78 38 12 3 1 7 24 49 64 60 37 16 4 5 16 35 58 63 44 19 6 1 2 11 34 67 80 63 32 12 2 1 4 16 36 48 47 30 14 4 2 9 23 40 44 32 15 5 1 1 6 20 43 54 44 24 10 3 0 2 8 21 30 30 21 12 4 1 7 17 28 30 21 10 4 1 1 4 12 25 32 26 15 7 2 0 1 4 10 16 16 12 7 2 1 3 8 13 13 9 6 2 1 0 2 6 11 14 12 8 4 1 0 1 2 4 6 7 6 4 1 0 1 2 3 3 3 2 1 0 0 1 2 3 4 3 2 1 0 0 0 0 1 2 2 2 1 0 !Region 9: Section 7->9 0 1 4 6 9 12 9 4 1 0 0 1 2 2 3 2 1 0 0 0 0 0 0 0 0 0 0 1 3 8 16 24 28 20 8 2 0 1 2 4 6 7 5 2 1 0 0 0 0 0 0 0 0 0 1 4 9 17 24 28 22 12 4 0 1 2 4 5 6 5 3 1 0 0 0 0 0 0 0 0 0 0 3 7 14 20 25 20 11 3 0 1 2 3 4 5 5 3 1 0 0 0 0 0 0 0 0 0 0 1 5 9 14 19 17 10 3 0 0 1 2 3 4 4 3 1 0 0 0 0 0 0 0 0 0 0 1 2 5 7 10 10 8 3 0 0 0 1 1 2 2 2 1 0 0 0 0 0 0 0 0 0 0 0 1 2 3 5 5 4 1 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 3 3 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ................ Refinement, sample 1 of 1 -- single-component data This sample is a single crystal with 3 indices (HKL) Orientation LS for Sample 1 of 1, component 1 in sample, 1 in .p4p/.spin file (203 input reflections)... Frame rows, columns: 1024 1536 Frame width (deg): 1.000 Relative SVD-filter threshold: 0.0000500 Starting gradient-expansion term: 0.0020000 Weighting multiplier for Z terms: 1.0000000 Minimum elements to filter: 0 Maximum number of LS cycles: 25 Vertical tilt of beam (deg): 0.2200 Individual reflection weights will be used in the refinement Wavelength, relative uncertainty: 1.5418400, 0.0000058 Component numbers S.C(F) below: S=sample, C=component in sample, F=component in file Reflection Summary: Component Input RLV.Excl Used WorstRes BestRes Min.2Th Max.2Th 1.1(1) 203 0 203 8.6888 0.8886 10.181 120.349 Orientation ('UB') matrix: 0.1442020 0.0357136 -0.0040241 0.0299507 -0.0024564 0.0772479 0.0657429 -0.0772160 -0.0043187 A B C Alpha Beta Gamma Vol 6.2423 11.7494 12.9954 90.000 96.661 90.000 946.69 0.0005 0.0005 0.0019 0.000 0.006 0.000 0.20 Corrected for goodness of fit: 0.0014 0.0014 0.0055 0.000 0.017 0.000 0.57 Crystal system constraint: 3 (Monoclinic B-uniq) Parameter constraint mask: T (512 = 200[hex]) T: Crystal Translations Eulerian angles (deg): 9.065 95.954 24.194 Goniometer zeros (deg): 0.0000* 0.0215 0.0000* 0.0294 (*=never refined) Crystal translations (pixels): 0.0000 0.0000 0.0000 Detector corrections: X-Cen Y-Cen Dist Pitch Roll Yaw -3.9284 -0.3545 0.0762 -0.1307 -0.1438 0.7710 Refinement statistics: StartingRes FinalRes GOF #Cycles #Filtered Code 1.16705e+04 4.63251e+03 2.85 3 4 0 Overall statistics for terms in X, Y, and Z: X Y Z Number of nonzero-weight terms: 203 203 181 Average input ESD (pix, pix, deg): 0.15608 0.12198 0.05488 Goodness of fit: 3.46792 2.67924 2.01368 Average missing volume: 0.044 Repeat orientation and spot-shape refinement ============= 10/26/2021 10:23:25 Current XYZ spot size: 0.780 0.780 2.270 Accurate-timing indicator is set in the frame headers: Velocity normalization will be computed for each frame Pixel spacing (deg): 0.129 Profile X,Y,Z spacing (deg): 0.109 0.090 0.328 Profile convolver halfwidth: 1.00 1.00 1.79 Background pixels updated = 92.85% Port, connections: 2000, 1 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 0_0001 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 17 0.78 0.78 2.27 1.000 1_0002 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 16 0.78 0.78 2.27 1.000 2_0003 4 0.02 0.06 -0.06 0.13 0.10 0.08 15451 29 0 0.39 23 0.78 0.78 2.27 1.000 3_0004 7 0.08 0.11 -0.03 0.14 0.17 0.11 41222 38 14 0.37 28 0.78 0.78 2.27 1.000 4_0005 9 0.38 0.00 -0.16 0.65 0.25 0.43 88096 75 0 0.63 33 0.78 0.78 2.27 1.000 5_0006 13 -0.00 -0.02 -0.02 0.21 0.08 0.10 71086 65 0 0.70 27 0.78 0.78 2.27 1.000 6_0007 8 0.00 0.02 0.06 0.20 0.20 0.08 66735 74 0 0.69 27 0.78 0.78 2.27 1.000 7_0008 12 0.12 -0.01 -0.02 0.24 0.13 0.19 22038 33 0 0.75 27 0.78 0.78 2.27 1.000 8_0009 5 -0.07 0.06 0.08 0.13 0.13 0.09 132389 97 0 0.84 37 0.78 0.78 2.27 1.000 9_0010 6 0.29 0.08 -0.02 0.80 0.14 0.14 56376 62 0 0.58 25 0.78 0.78 2.27 1.000 10_0011 12 -0.01 -0.03 0.05 0.16 0.09 0.09 55076 65 0 0.67 29 0.78 0.78 2.27 1.000 11_0012 12 0.19 -0.06 -0.05 0.48 0.12 0.23 41466 51 8 0.68 26 0.78 0.78 2.27 1.000 12_0013 6 0.00 -0.03 0.01 0.09 0.06 0.06 25994 38 17 0.62 28 0.78 0.78 2.27 1.000 13_0014 9 -0.12 -0.03 0.02 0.32 0.14 0.12 36552 55 0 0.67 28 0.78 0.78 2.27 1.000 14_0015 12 -0.00 -0.03 0.02 0.28 0.10 0.08 63496 55 0 0.71 29 0.78 0.78 2.27 1.000 15_0016 9 -0.05 -0.06 0.10 0.13 0.09 0.19 68983 67 0 0.76 28 0.78 0.78 2.27 1.000 16_0017 5 -0.12 -0.00 -0.04 0.26 0.10 0.12 46150 79 0 0.68 35 0.78 0.78 2.27 1.000 17_0018 14 -0.03 -0.06 0.05 0.10 0.08 0.12 77889 76 0 0.69 27 0.78 0.78 2.27 1.000 18_0019 10 0.08 0.05 0.01 0.24 0.35 0.16 66473 63 0 0.71 28 0.78 0.78 2.27 1.000 19_0020 10 -0.06 -0.02 -0.06 0.30 0.16 0.14 80200 66 0 0.67 27 0.78 0.78 2.27 1.000 Background pixels updated = 93.28% Port, connections: 2000, 1 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 20_0021 8 -0.06 -0.09 0.07 0.41 0.11 0.15 61273 57 13 0.71 28 0.78 0.78 2.27 1.000 21_0022 4 0.16 -0.09 0.08 0.40 0.19 0.21 11589 26 0 0.83 24 0.78 0.78 2.27 1.000 22_0023 6 0.10 -0.09 -0.01 0.13 0.10 0.10 22078 39 0 0.64 27 0.78 0.78 2.27 1.000 23_0024 10 0.16 -0.13 -0.01 0.57 0.26 0.12 73125 66 0 0.70 27 0.78 0.78 2.27 1.000 24_0025 8 0.00 -0.06 -0.03 0.09 0.08 0.18 195855 126 0 0.72 28 0.78 0.78 2.27 1.000 25_0026 10 -0.01 -0.09 0.04 0.23 0.12 0.15 16630 33 0 0.72 27 0.78 0.78 2.27 1.000 26_0027 6 0.01 -0.06 -0.19 0.11 0.06 0.31 59478 65 0 0.77 22 0.78 0.78 2.27 1.000 27_0028 11 -0.39 -0.07 0.21 1.25 0.09 0.67 71945 61 9 0.77 31 0.78 0.78 2.27 1.000 I/Sigma = 64.84 Thresh = 0.020 Blend = F #Contributing = 53 InitialProfileWt = 0.041 Region 1 Sum = 20332.7; Maximum = 257.788; FM = 0.766 !Region 1: Section 1->3 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 3 8 8 5 3 2 1 0 0 1 1 0 0 0 0 0 0 0 5 11 8 4 1 0 0 0 0 14 39 34 21 10 4 2 1 0 0 1 0 0 0 0 0 0 0 3 6 5 3 1 1 1 1 0 12 33 34 26 14 6 2 1 0 0 1 0 0 0 0 0 0 0 3 6 5 3 1 1 1 1 0 11 31 32 24 13 6 3 1 0 0 0 0 0 0 0 0 0 0 2 4 4 3 1 1 1 0 0 10 29 33 25 15 7 3 1 0 0 0 0 0 0 0 0 0 0 1 2 2 2 1 1 1 1 0 6 18 22 18 11 6 2 1 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 0 1 0 0 3 10 13 12 8 4 2 1 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 2 6 8 7 5 2 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 2 2 2 1 1 0 0 0 !Region 1: Section 4->6 5 18 18 14 11 6 3 2 0 3 13 13 13 12 9 5 4 1 0 2 3 4 5 5 5 4 1 17 55 64 56 36 19 9 4 1 8 33 53 63 55 37 20 9 2 1 7 16 25 32 27 19 11 3 19 65 83 74 51 28 13 5 1 12 46 71 78 69 51 28 13 3 2 9 20 29 38 39 29 17 5 17 59 77 76 60 37 18 8 2 10 44 74 93 95 73 41 20 5 2 11 25 42 59 59 44 26 8 17 62 85 82 62 38 18 8 2 11 48 83100 97 78 47 24 6 2 12 28 46 60 68 55 36 11 12 41 59 60 46 30 15 8 2 7 31 56 72 70 58 37 21 5 1 7 18 33 46 54 47 33 10 6 23 37 43 37 24 12 5 1 4 19 40 59 64 55 35 19 5 1 6 16 29 44 53 47 33 11 4 14 22 24 20 12 6 3 1 3 11 22 30 31 28 20 13 4 1 3 8 14 21 28 30 25 8 1 5 6 8 7 5 2 1 0 1 4 7 11 13 12 8 6 2 0 1 2 6 9 13 13 13 5 !Region 1: Section 7->9 0 0 0 1 1 2 2 2 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 3 7 9 9 7 2 0 0 0 1 1 2 2 2 1 0 0 0 0 0 0 0 0 0 0 1 2 4 9 15 16 12 4 0 0 0 0 1 3 4 4 1 0 0 0 0 0 0 0 0 0 0 1 2 6 15 24 26 20 7 0 0 0 1 2 5 6 6 2 0 0 0 0 0 0 0 0 0 0 1 3 7 16 27 33 28 10 0 1 1 1 2 4 8 9 3 0 0 0 0 0 0 0 0 0 0 1 2 6 16 26 32 28 10 0 0 1 1 3 5 8 8 3 0 0 0 0 0 0 0 0 0 0 1 2 5 13 23 30 28 11 0 0 1 1 2 4 8 8 3 0 0 0 0 0 0 0 0 0 0 0 1 2 6 13 22 22 8 0 0 1 1 1 3 6 7 3 0 0 0 0 0 0 0 0 0 0 0 0 1 3 7 9 13 6 0 0 0 0 1 1 2 4 2 0 0 0 0 0 0 0 0 0 I/Sigma = 258.51 Thresh = 0.020 Blend = F #Contributing = 38 InitialProfileWt = 0.053 Region 2 Sum = 337230; Maximum = 6218.29; FM = 0.953 !Region 2: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 2 4 4 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 5 3 1 0 0 0 1 5 13 19 12 5 2 0 0 0 0 0 0 0 0 0 0 0 1 2 4 5 4 1 0 0 0 2 8 17 25 20 10 5 1 0 0 0 0 0 0 0 0 0 0 0 2 4 6 5 2 1 0 0 2 9 20 31 29 19 8 1 0 0 0 0 0 0 0 0 0 0 0 1 2 4 4 2 1 0 0 2 7 16 28 29 20 7 1 0 0 0 0 0 0 0 0 0 0 0 1 2 3 2 1 0 0 0 1 5 14 25 23 12 3 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 2 7 16 14 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 7 5 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 !Region 2: Section 4->6 0 0 2 4 7 4 2 1 0 0 0 1 3 7 5 1 0 0 0 0 1 2 6 5 1 0 0 0 2 8 20 32 22 8 4 1 0 1 6 17 33 25 8 3 0 0 1 3 10 20 18 8 2 0 0 3 13 35 57 45 21 9 1 0 2 11 37 71 58 22 6 1 0 1 6 24 47 42 16 3 1 1 4 19 48 74 69 39 14 2 0 5 24 67100 88 39 10 1 0 4 18 52 73 65 29 7 1 0 5 22 49 72 72 45 14 1 1 8 38 74 96 88 45 11 1 0 7 30 56 67 59 29 7 1 0 3 17 40 62 57 30 8 1 0 7 33 65 84 76 40 10 1 0 7 29 55 65 62 36 11 2 0 2 9 25 42 34 14 3 0 0 4 18 44 56 44 19 6 1 0 4 16 36 44 37 20 7 2 0 1 4 11 20 14 5 2 0 0 2 8 20 28 21 10 3 1 0 2 7 17 23 21 13 5 1 0 0 1 3 4 3 1 0 0 0 1 2 6 8 8 2 1 0 0 1 2 5 9 11 3 1 1 !Region 2: Section 7->9 0 0 0 1 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 6 7 4 1 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 3 9 14 13 6 2 0 0 0 1 1 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 2 7 19 24 23 13 4 1 0 0 1 3 3 3 2 1 0 0 0 0 0 0 0 0 0 0 0 3 11 20 23 20 11 4 1 0 1 2 3 4 3 2 1 0 0 0 0 0 0 0 0 0 0 0 3 11 21 24 24 17 6 2 0 1 2 3 3 3 3 1 0 0 0 0 0 0 0 0 0 0 0 2 7 13 17 17 11 5 2 0 1 1 2 3 3 2 1 0 0 0 0 0 0 0 0 0 0 0 1 3 6 10 11 8 4 1 0 0 1 1 2 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 4 5 2 1 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 110.15 Thresh = 0.020 Blend = F #Contributing = 32 InitialProfileWt = 0.069 Region 3 Sum = 63594.6; Maximum = 1228.36; FM = 0.878 !Region 3: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 1 1 3 1 0 0 0 1 2 6 9 11 5 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 3 2 1 0 0 2 5 11 19 20 12 6 1 0 0 0 0 0 0 0 0 0 0 0 1 1 2 2 2 1 0 0 2 6 14 24 23 14 6 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 2 1 0 0 2 6 13 20 21 13 4 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 1 4 10 17 17 9 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 1 3 6 12 11 6 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 7 6 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 !Region 3: Section 4->6 1 2 6 15 21 17 7 2 0 1 2 6 13 18 14 5 1 0 0 1 2 3 5 5 2 0 0 1 6 16 31 46 45 23 8 1 1 5 16 31 45 41 18 5 1 0 1 5 10 16 14 6 1 0 1 6 20 44 68 61 29 10 1 1 7 21 49 74 66 27 7 1 0 2 7 19 31 28 11 2 0 1 6 23 51 71 67 33 9 1 1 8 28 68 96 88 40 9 1 1 3 11 32 50 45 19 4 0 1 5 19 47 67 59 28 7 1 1 7 29 74100 85 37 8 1 1 3 15 42 59 49 21 4 0 0 3 15 38 55 46 20 5 1 1 5 27 68 90 73 32 7 1 0 3 17 45 60 49 21 5 0 0 2 9 26 38 30 12 3 1 0 3 17 50 72 58 25 6 1 0 3 14 39 56 45 20 5 1 0 1 4 13 18 14 6 2 0 0 2 10 30 42 33 14 4 1 0 2 9 26 38 31 14 4 1 0 0 1 4 6 5 2 1 0 0 0 3 11 16 13 5 1 0 0 1 3 11 16 14 6 2 0 !Region 3: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 4 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 5 8 7 3 1 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 9 13 10 4 1 0 0 0 0 1 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 1 5 12 18 16 7 2 0 0 0 1 2 3 3 2 1 0 0 0 0 0 0 0 0 0 0 0 2 6 15 21 17 8 3 0 0 0 1 3 4 4 2 1 0 0 0 0 0 0 0 0 0 0 0 2 5 11 17 15 8 3 1 0 1 1 2 4 4 2 1 0 0 0 0 0 0 0 0 0 0 0 1 2 5 8 8 4 2 0 0 0 0 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 I/Sigma = 64.80 Thresh = 0.020 Blend = F #Contributing = 12 InitialProfileWt = 0.344 Region 4 Sum = 14661.2; Maximum = 231.837; FM = 0.786 !Region 4: Section 1->3 0 0 0 0 0 0 0 0 0 0 1 4 2 1 0 0 0 0 1 9 15 8 5 1 0 0 0 0 0 0 0 0 0 0 0 0 2 7 7 4 2 1 1 0 0 7 27 28 19 8 3 1 0 0 0 0 0 0 0 0 0 0 0 1 5 5 4 2 1 1 0 0 5 21 24 18 9 3 1 1 0 0 0 0 0 0 1 0 0 0 1 4 4 3 1 1 1 0 0 4 16 19 16 8 4 2 1 0 0 0 0 0 0 0 0 0 0 0 2 3 2 1 1 1 0 0 2 9 14 12 7 4 2 1 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 0 0 1 4 8 8 6 3 2 1 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 2 4 4 4 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 !Region 4: Section 4->6 2 13 19 13 8 3 1 0 0 1 7 14 16 9 5 2 0 0 0 2 7 10 5 4 2 0 0 8 33 40 36 21 8 3 1 0 4 18 34 48 36 16 7 2 1 1 6 17 31 28 14 6 2 1 7 28 42 42 27 13 5 1 0 4 19 44 65 55 32 14 3 1 2 8 24 45 45 28 13 4 1 5 24 40 44 35 20 8 2 1 3 18 50 80 84 55 25 7 2 1 8 30 59 71 52 24 8 2 3 16 33 41 38 25 12 4 1 2 16 49 84100 78 39 13 3 1 8 32 65 89 75 38 14 3 2 8 22 33 35 28 14 5 1 2 10 39 74 99 93 52 19 4 1 6 27 60 91 91 54 22 5 1 4 11 21 28 24 15 6 1 1 5 22 52 86 83 57 25 6 1 4 17 44 82 87 61 30 7 1 2 5 12 19 17 12 6 1 1 3 11 33 63 64 48 26 6 0 2 9 30 63 69 55 33 7 0 1 1 4 9 7 4 4 1 0 1 2 11 30 26 16 17 3 0 1 2 11 30 27 18 20 3 !Region 4: Section 7->9 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 5 6 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 8 10 7 3 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 5 11 16 13 6 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 6 13 20 19 10 5 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 1 1 5 13 22 24 16 8 2 0 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 1 3 10 21 25 20 12 3 0 0 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 1 2 7 17 22 19 13 3 0 0 0 0 0 1 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 3 8 9 7 7 1 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 I/Sigma = 35.70 Thresh = 0.020 Blend = F #Contributing = 8 InitialProfileWt = 0.393 Region 5 Sum = 6813.26; Maximum = 103.021; FM = 0.741 !Region 5: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 2 4 3 1 0 0 0 0 0 0 0 0 0 1 1 0 0 0 2 2 1 0 1 1 1 0 1 11 12 8 3 2 1 0 0 0 0 1 0 0 0 0 0 0 0 3 4 2 1 1 1 0 0 2 15 17 11 6 3 2 0 0 0 0 0 0 0 0 0 0 0 0 3 2 2 1 1 0 0 0 2 15 16 12 7 5 3 0 0 0 0 0 0 0 0 0 0 0 0 2 2 2 2 1 0 0 0 2 11 15 12 8 6 3 1 0 0 0 0 0 0 1 0 0 0 0 1 2 1 1 1 1 0 0 1 7 12 11 7 6 4 2 0 0 0 0 0 0 1 0 0 0 0 1 2 1 1 1 0 -1 0 1 5 8 7 5 5 3 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 0 0 0 0 3 4 3 3 3 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 0 0 !Region 5: Section 4->6 0 4 16 12 7 3 1 0 0 0 4 18 16 12 5 2 1 0 0 1 7 8 7 2 1 1 0 5 41 47 39 24 10 4 1 0 5 48 57 52 38 16 7 2 0 2 16 21 22 21 10 6 3 0 10 62 68 57 36 20 7 2 0 12 77 85 77 54 33 13 5 1 4 26 31 32 28 22 10 5 1 9 59 75 68 46 31 14 4 0 11 73 95 93 72 53 24 10 2 4 26 35 39 41 37 18 10 2 7 49 70 71 50 39 22 8 1 8 62 91100 81 68 43 19 3 3 23 34 43 49 49 34 22 5 4 30 54 65 46 40 28 11 1 4 38 70 92 76 73 55 27 4 1 14 27 39 46 56 48 31 7 2 17 33 44 34 32 25 10 1 2 20 43 64 58 59 51 28 4 1 8 18 29 36 46 45 35 8 1 8 17 25 19 19 18 7 0 1 9 22 37 33 38 39 21 3 0 4 9 16 21 33 36 28 5 0 1 4 7 5 5 6 1 0 0 2 6 11 10 11 12 4 0 0 1 3 5 7 11 12 7 0 !Region 5: Section 7->9 0 0 1 2 2 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 4 3 2 3 0 0 0 1 0 0 0 1 1 0 0 -1 0 0 -1 0 0 0 0 0 1 2 4 6 6 4 3 1 0 0 1 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 2 2 5 9 11 6 6 1 0 1 1 1 1 2 1 2 0 0 0 0 0 0 1 0 1 0 0 2 3 6 12 14 12 12 4 0 0 1 1 2 1 1 3 1 0 0 0 0 1 0 0 0 0 0 1 2 6 13 18 18 18 6 0 1 0 1 2 2 3 4 2 0 0 0 0 0 0 1 -1 0 0 1 2 5 9 16 17 22 6 0 0 0 1 1 2 2 7 2 0 0 0 0 -1 0 0 1 0 0 1 2 2 6 11 15 18 4 0 0 1 0 1 1 2 5 1 0 0 0 0 0 0 0 0 0 0 1 1 1 2 4 5 3 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 38.59 Thresh = 0.020 Blend = F #Contributing = 6 InitialProfileWt = 0.513 Region 6 Sum = 4887.96; Maximum = 69.3839; FM = 0.655 !Region 6: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 4 5 4 3 0 0 0 0 0 1 1 0 1 0 1 0 0 0 2 2 1 1 1 2 0 0 4 16 14 11 8 5 2 1 0 0 1 1 1 2 1 1 0 0 0 2 3 1 2 2 2 0 0 5 26 21 18 13 9 4 1 0 0 0 1 0 1 1 1 1 0 0 2 3 1 2 1 1 1 0 6 34 30 22 18 12 5 3 0 0 0 1 1 0 0 1 1 0 0 2 3 2 1 1 1 1 0 7 35 33 25 21 16 8 4 1 0 0 1 2 1 1 1 0 0 0 2 3 3 2 1 2 1 0 6 28 30 25 21 15 9 4 0 0 1 0 1 1 1 1 0 0 0 2 2 2 2 1 2 0 0 4 22 25 20 16 11 7 3 0 0 0 0 0 1 0 1 1 0 0 2 1 1 2 0 1 1 0 3 14 14 11 11 6 4 2 0 0 0 0 -1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 5 4 4 3 2 1 1 0 !Region 6: Section 4->6 2 11 14 12 11 2 1 2 0 1 8 12 13 11 3 2 2 0 0 1 3 5 5 3 2 2 0 13 50 43 36 26 15 5 3 0 11 42 38 33 26 16 8 4 0 2 8 10 11 11 9 8 5 1 17 78 64 55 43 28 10 3 0 14 63 55 49 44 30 14 6 0 2 11 14 14 18 17 12 9 1 20 97 88 71 58 41 18 7 1 16 76 74 64 58 46 24 12 1 3 14 17 19 25 25 21 16 2 21100 96 78 65 53 29 11 1 17 78 79 71 63 57 35 16 1 3 13 18 22 28 31 28 23 3 17 81 86 75 64 52 29 11 1 13 64 70 68 63 57 37 18 1 2 11 15 22 28 33 30 28 4 12 62 70 59 49 37 24 10 0 9 47 56 52 48 42 32 17 1 1 7 11 16 21 25 26 25 3 8 36 39 34 32 23 15 7 0 6 26 31 30 31 27 21 12 1 1 4 6 10 14 16 18 16 2 3 11 11 12 10 5 5 2 0 2 7 9 10 10 7 7 4 0 0 1 2 3 4 6 6 6 1 !Region 6: Section 7->9 0 0 1 1 2 2 2 2 0 0 0 0 1 1 0 0 1 0 0 0 0 0 0 0 0 0 0 0 1 2 2 3 5 5 5 1 0 1 0 1 1 2 1 2 1 0 0 0 0 1 0 0 0 0 0 4 4 3 5 8 7 9 2 0 2 2 1 1 2 2 4 1 0 0 1 0 1 0 0 0 0 0 3 4 5 8 10 14 15 3 0 2 1 1 2 2 4 5 1 0 1 0 0 0 0 0 0 0 0 2 4 7 10 13 18 24 4 0 1 2 2 2 3 6 8 2 0 0 0 0 0 1 0 0 0 0 1 3 7 10 15 20 30 5 0 0 1 2 2 4 7 11 2 0 0 0 0 1 1 1 0 0 0 1 3 5 7 10 15 22 4 0 0 1 2 1 2 4 8 2 0 0 0 0 0 0 0 0 0 0 1 2 4 5 6 9 14 3 0 0 1 1 2 1 2 5 1 0 0 0 0 1 0 0 0 0 0 1 1 2 2 2 4 6 1 0 0 1 1 0 0 1 2 1 0 0 0 0 0 0 0 0 0 I/Sigma = 41.55 Thresh = 0.020 Blend = F #Contributing = 12 InitialProfileWt = 0.263 Region 7 Sum = 8748.04; Maximum = 119.912; FM = 0.717 !Region 7: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 0 0 1 3 3 3 2 1 1 0 0 0 0 1 1 0 0 0 0 0 0 0 1 1 0 1 1 0 0 1 7 8 8 6 4 2 1 0 0 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 3 14 13 11 9 6 3 1 0 0 1 1 0 1 0 0 0 0 1 2 1 0 1 0 0 0 0 4 20 19 17 13 8 4 1 0 0 0 0 0 0 1 0 0 0 0 1 1 1 0 1 1 0 0 4 24 23 20 16 9 4 2 0 0 0 0 0 0 0 1 0 0 0 1 1 1 1 1 2 0 0 4 25 25 21 15 9 5 2 0 0 0 0 0 0 0 1 0 0 0 1 1 1 1 0 1 0 0 3 22 23 18 13 8 3 2 0 0 0 0 0 1 0 0 0 0 0 1 1 0 1 0 0 0 0 2 14 17 14 9 5 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 5 5 3 1 1 0 0 !Region 7: Section 4->6 2 9 9 11 10 7 4 2 0 2 8 10 13 12 11 7 3 0 0 2 3 5 5 6 5 2 0 4 24 31 34 30 22 14 9 1 4 21 33 39 38 30 23 17 3 1 5 9 14 15 16 16 16 4 8 43 53 53 48 34 22 14 2 6 37 56 63 59 45 36 26 5 1 9 16 21 22 23 27 29 6 10 61 73 76 63 41 27 14 2 8 52 75 86 78 55 42 27 5 2 12 22 29 30 28 33 33 7 13 73 86 89 72 48 30 15 2 11 63 86100 86 63 47 28 4 3 15 25 33 33 31 37 34 7 13 75 88 84 66 46 28 15 2 11 65 88 92 76 58 42 26 4 2 16 25 31 28 28 33 31 6 10 64 78 69 51 35 20 9 1 8 55 74 73 57 43 30 16 2 2 13 20 24 21 21 24 19 3 6 43 55 47 33 22 11 5 0 5 38 51 47 37 26 16 8 1 1 9 14 14 14 12 12 10 2 1 10 18 16 11 8 4 2 0 0 9 17 16 12 9 5 3 0 0 3 4 5 5 4 4 3 1 !Region 7: Section 7->9 0 0 0 1 2 2 2 1 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 -1 0 0 0 0 0 2 4 7 8 11 3 0 0 0 1 2 2 2 2 1 0 0 -1 0 0 0 0 -1 0 0 1 1 2 4 8 15 21 5 0 0 0 0 1 2 3 6 1 0 0 -1 -1 0 1 0 0 0 0 1 2 3 5 9 20 27 6 0 1 0 1 1 2 5 8 2 0 0 0 0 0 0 0 1 0 0 2 2 3 6 10 21 28 6 0 1 1 1 1 2 5 8 2 0 0 0 0 0 0 0 1 0 0 2 3 4 5 9 20 26 5 0 1 2 1 2 2 5 7 1 0 0 1 0 0 0 0 0 0 0 1 1 3 4 8 16 16 3 0 0 1 1 1 2 4 4 1 0 0 0 0 0 0 0 0 0 0 0 0 1 3 4 8 9 2 0 0 0 0 1 1 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 2 3 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 I/Sigma = 71.39 Thresh = 0.020 Blend = F #Contributing = 9 InitialProfileWt = 0.301 Region 8 Sum = 21375.5; Maximum = 334.387; FM = 0.761 !Region 8: Section 1->3 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 1 1 1 1 0 0 0 0 0 0 0 0 1 0 0 0 0 1 1 1 1 1 0 0 0 1 3 3 4 3 2 1 1 0 0 0 0 0 0 0 0 0 0 1 2 2 1 1 1 1 1 0 2 9 8 7 5 2 1 1 0 0 0 0 0 0 0 0 0 0 2 4 4 3 1 1 1 1 0 6 19 18 14 7 3 1 1 0 0 0 0 0 0 0 0 0 0 3 7 6 4 2 1 1 0 0 12 28 26 18 9 3 2 1 0 0 0 0 0 0 0 0 0 0 5 9 7 4 2 1 1 0 0 16 34 30 19 10 3 2 1 0 0 0 0 0 0 0 0 0 0 5 9 7 4 2 1 1 0 0 16 32 26 17 9 4 2 1 0 0 0 0 0 0 0 0 0 0 4 6 5 3 1 1 1 0 0 12 24 19 13 6 2 1 1 0 0 0 0 0 0 0 0 0 0 1 2 2 1 1 0 0 0 0 2 6 7 4 2 1 0 0 0 !Region 8: Section 4->6 1 1 2 5 9 7 6 3 0 0 1 4 12 26 22 22 9 1 0 1 3 11 22 21 24 10 1 1 4 7 15 24 21 14 7 1 1 4 12 34 71 71 54 31 6 0 2 8 27 62 69 58 38 9 3 11 15 25 33 27 16 9 2 2 8 22 52 91 88 60 35 8 1 3 14 40 77 83 64 42 11 7 23 28 35 39 29 17 9 2 3 14 31 66100 89 59 32 7 1 6 18 47 81 82 61 37 10 11 32 37 42 38 26 15 7 1 3 17 37 72 91 76 48 24 5 1 7 21 51 73 66 46 27 6 14 36 40 41 36 20 11 5 1 4 16 37 65 77 55 34 16 3 1 6 21 43 58 47 31 17 4 13 33 34 34 26 15 8 3 1 3 14 31 51 52 38 22 9 2 1 5 17 32 37 30 19 10 2 10 24 24 24 17 9 4 2 0 2 10 21 34 31 22 11 5 1 0 3 12 20 21 17 10 5 2 1 6 9 8 5 3 1 1 0 0 2 7 10 9 6 3 2 1 0 0 4 6 6 4 3 2 1 !Region 8: Section 7->9 0 0 1 2 4 6 8 3 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 1 1 5 12 16 17 14 4 0 0 0 0 0 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 2 6 14 19 19 15 5 0 0 0 0 1 1 1 2 1 0 0 0 0 0 0 0 0 0 0 1 2 7 14 18 17 13 5 0 0 1 0 1 1 1 2 1 0 0 0 0 0 0 0 0 0 0 1 2 6 12 13 12 9 3 0 1 1 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 1 2 5 8 9 8 6 2 0 0 1 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 1 2 3 5 5 4 3 1 0 0 1 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 3 2 2 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 144.24 Thresh = 0.020 Blend = F #Contributing = 32 InitialProfileWt = 0.090 Region 9 Sum = 86971.2; Maximum = 1505.22; FM = 0.91 !Region 9: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 1 3 4 6 5 3 1 0 0 0 0 0 0 0 0 0 0 0 1 1 2 2 2 1 0 0 0 1 6 13 18 17 7 2 1 0 0 0 0 0 0 0 0 0 0 1 3 3 3 3 2 1 0 0 3 10 15 21 22 12 3 1 0 0 0 0 0 0 0 0 0 0 1 3 3 4 4 3 1 0 0 3 9 16 25 27 17 6 1 0 0 0 0 0 0 0 0 0 0 1 2 3 4 5 3 1 0 0 2 9 17 26 28 19 7 2 0 0 0 0 0 0 0 0 0 0 1 2 2 3 3 3 1 0 0 2 6 11 16 18 13 6 2 0 0 0 0 0 0 0 0 0 0 1 1 1 2 2 2 1 0 0 1 3 6 10 11 8 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 2 3 3 2 1 0 0 !Region 9: Section 4->6 0 2 5 9 10 5 2 1 0 0 1 5 13 18 11 4 1 0 0 0 3 9 14 12 6 2 0 1 4 11 23 27 15 5 2 0 0 3 12 37 50 33 14 5 1 0 1 9 27 41 36 20 8 2 1 12 32 56 58 32 11 3 1 0 8 31 73 86 58 24 8 1 0 3 15 42 60 50 27 11 2 2 16 39 64 70 44 15 4 1 1 12 43 85100 74 31 9 2 0 4 22 49 65 57 31 12 2 2 16 39 66 75 51 21 6 1 1 12 41 81100 77 37 12 2 1 4 19 43 60 54 32 14 4 2 17 39 64 70 49 22 7 1 1 12 35 68 84 66 33 12 3 0 3 13 30 44 41 25 11 3 1 10 24 38 44 33 15 6 1 1 7 20 40 52 43 22 10 2 0 2 7 17 27 26 17 10 2 1 5 12 21 24 18 9 4 1 0 4 9 19 26 22 13 6 2 0 1 2 7 12 12 9 6 2 0 2 4 7 7 6 3 2 0 0 1 3 6 7 7 5 2 0 0 0 1 2 3 3 3 2 0 !Region 9: Section 7->9 0 0 2 5 7 8 5 2 0 0 0 1 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 1 5 11 18 21 14 6 2 0 0 1 3 5 5 3 2 0 0 0 0 0 0 0 0 0 0 0 2 6 15 24 25 16 7 2 0 0 2 4 6 7 4 2 0 0 0 0 0 0 0 0 0 0 0 2 7 15 23 24 18 8 2 0 1 2 4 5 6 5 2 1 0 0 0 0 0 0 0 0 0 0 1 5 11 18 20 16 9 3 0 0 1 2 4 5 4 2 1 0 0 0 0 0 0 0 0 0 0 1 2 6 11 13 11 7 2 0 0 1 1 2 3 3 2 1 0 0 0 0 0 0 0 0 0 0 1 1 3 6 8 8 6 1 0 0 0 1 1 2 2 2 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 3 4 4 1 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ................ Refinement, sample 1 of 1 -- single-component data This sample is a single crystal with 3 indices (HKL) Orientation LS for Sample 1 of 1, component 1 in sample, 1 in .p4p/.spin file (202 input reflections)... Frame rows, columns: 1024 1536 Frame width (deg): 1.000 Relative SVD-filter threshold: 0.0000500 Starting gradient-expansion term: 0.0020000 Weighting multiplier for Z terms: 1.0000000 Minimum elements to filter: 0 Maximum number of LS cycles: 25 Vertical tilt of beam (deg): 0.2200 Individual reflection weights will be used in the refinement Wavelength, relative uncertainty: 1.5418400, 0.0000058 Component numbers S.C(F) below: S=sample, C=component in sample, F=component in file Reflection Summary: Component Input RLV.Excl Used WorstRes BestRes Min.2Th Max.2Th 1.1(1) 202 0 202 8.6924 0.8888 10.176 120.319 Orientation ('UB') matrix: 0.1441990 0.0357116 -0.0039164 0.0297486 -0.0024521 0.0771954 0.0657534 -0.0772071 -0.0042632 A B C Alpha Beta Gamma Vol 6.2439 11.7507 13.0061 90.000 96.677 90.000 947.78 0.0005 0.0005 0.0019 0.000 0.006 0.000 0.19 Corrected for goodness of fit: 0.0013 0.0014 0.0052 0.000 0.017 0.000 0.54 Crystal system constraint: 3 (Monoclinic B-uniq) Parameter constraint mask: T (512 = 200[hex]) T: Crystal Translations Eulerian angles (deg): 9.001 95.923 24.202 Goniometer zeros (deg): 0.0000* 0.0330 0.0000* 0.0196 (*=never refined) Crystal translations (pixels): 0.0000 0.0000 0.0000 Detector corrections: X-Cen Y-Cen Dist Pitch Roll Yaw -4.0866 -0.2820 0.0757 -0.1219 -0.1300 0.8018 Refinement statistics: StartingRes FinalRes GOF #Cycles #Filtered Code 4.89067e+03 4.42997e+03 2.81 25 2 1 Overall statistics for terms in X, Y, and Z: X Y Z Number of nonzero-weight terms: 202 202 174 Average input ESD (pix, pix, deg): 0.14150 0.11309 0.05008 Goodness of fit: 3.48961 2.50950 2.00292 Old XYZ spot size: 0.780 0.780 2.270 New XYZ spot size: 2.253 2.321 2.129 Average missing volume: 0.043 % with too much missing I: 3.448 Fractional overlap in H,K,L: 0.000 0.000 0.000 End of pass 2. Repeating shape determination... Repeat orientation and spot-shape refinement ============= 10/26/2021 10:23:26 Current XYZ spot size: 2.253 2.321 2.129 Accurate-timing indicator is set in the frame headers: Velocity normalization will be computed for each frame Pixel spacing (deg): 0.129 Profile X,Y,Z spacing (deg): 0.315 0.268 0.316 Profile convolver halfwidth: 1.00 1.00 1.86 Background pixels updated = 92.54% Port, connections: 2000, 1 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 0_0001 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 17 0.00 0.00 2.91 1.000 1_0002 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 16 0.00 0.00 2.91 1.000 2_0003 3 0.01 0.06 -0.01 0.07 0.06 0.04 24468 29 0 0.52 23 3.79 3.51 2.91 1.000 3_0004 8 -0.07 0.02 -0.02 0.51 0.22 0.07 41366 41 13 0.38 27 4.04 4.45 2.91 1.000 4_0005 10 0.17 0.04 -0.01 0.32 0.17 0.06 96649 85 0 0.70 33 3.51 4.40 2.82 1.000 5_0006 13 -0.06 -0.01 0.01 0.18 0.17 0.08 77182 68 0 0.77 27 3.03 3.67 2.83 1.000 6_0007 8 0.21 0.24 0.01 0.71 0.56 0.14 71414 76 0 0.79 27 2.97 3.57 2.81 1.000 7_0008 12 0.06 -0.01 0.02 0.22 0.12 0.19 29959 37 0 0.82 27 2.90 3.43 2.81 1.000 8_0009 5 -0.08 0.02 0.00 0.11 0.06 0.05 148586 101 0 0.89 37 2.85 3.48 2.77 1.000 9_0010 6 0.52 0.07 -0.01 1.31 0.13 0.06 62097 65 0 0.67 25 2.88 3.48 2.74 1.000 10_0011 12 0.05 -0.05 -0.02 0.16 0.13 0.07 61159 69 0 0.76 29 2.92 3.53 2.73 1.000 11_0012 11 0.22 -0.05 -0.03 0.47 0.17 0.10 48166 54 0 0.79 26 2.99 3.51 2.74 1.000 12_0013 7 0.01 -0.01 0.01 0.15 0.08 0.07 34972 45 14 0.65 27 2.95 3.49 2.75 1.000 13_0014 9 -0.14 -0.06 0.03 0.33 0.25 0.09 39267 57 0 0.75 28 2.90 3.41 2.73 1.000 14_0015 11 0.06 -0.11 -0.05 0.51 0.33 0.12 80421 62 0 0.80 28 3.00 3.49 2.74 1.000 15_0016 10 -0.02 -0.00 -0.00 0.11 0.07 0.06 70176 66 0 0.80 27 2.95 3.47 2.71 1.000 16_0017 4 -0.25 0.07 0.02 0.39 0.16 0.13 58784 95 0 0.79 35 2.94 3.47 2.70 1.000 17_0018 13 -0.01 -0.02 0.01 0.11 0.04 0.04 84326 78 0 0.80 27 2.89 3.44 2.69 1.000 18_0019 12 0.12 0.04 -0.04 0.30 0.24 0.09 70959 67 0 0.73 27 2.89 3.44 2.71 1.000 19_0020 9 -0.05 -0.02 -0.02 0.09 0.07 0.04 102336 77 0 0.75 26 2.86 3.44 2.68 1.000 Background pixels updated = 92.88% Port, connections: 2000, 1 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 20_0021 8 0.07 -0.05 -0.03 0.35 0.17 0.15 66748 59 13 0.77 27 2.84 3.42 2.68 1.000 21_0022 4 0.08 -0.08 -0.10 0.25 0.15 0.23 14592 28 0 0.86 24 2.84 3.43 2.69 1.000 22_0023 5 0.04 -0.09 -0.01 0.11 0.12 0.04 28210 44 0 0.74 28 2.82 3.41 2.68 1.000 23_0024 11 -0.06 0.02 0.02 0.19 0.16 0.08 78508 68 0 0.75 27 2.79 3.41 2.67 1.000 24_0025 8 -0.01 -0.06 -0.00 0.12 0.11 0.06 207302 131 0 0.79 28 2.77 3.43 2.68 1.000 25_0026 10 -0.03 -0.05 0.01 0.34 0.16 0.13 20484 36 0 0.80 27 2.75 3.42 2.69 1.000 26_0027 6 0.10 -0.09 -0.03 0.30 0.14 0.06 66797 67 0 0.83 22 2.73 3.40 2.69 1.000 27_0028 10 0.01 -0.06 -0.02 0.09 0.09 0.04 86006 70 0 0.85 30 2.70 3.41 2.69 1.000 I/Sigma = 67.31 Thresh = 0.020 Blend = F #Contributing = 54 InitialProfileWt = 0.041 Region 1 Sum = 28416.6; Maximum = 1469.35; FM = 0.846 !Region 1: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 1 2 2 1 0 0 0 0 0 1 1 1 0 0 0 0 0 0 2 4 4 1 0 0 0 0 0 2 7 11 4 1 0 0 0 0 1 1 1 0 0 0 0 0 0 2 6 8 2 1 0 0 0 0 2 14 34 16 2 1 0 0 0 0 1 1 0 0 0 0 0 0 1 4 5 2 1 1 0 0 0 1 10 33 21 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 3 10 8 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 1: Section 4->6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 1 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 1 1 1 0 0 0 1 6 15 9 2 1 0 0 0 0 3 10 9 3 1 1 0 0 0 1 2 4 3 1 0 0 0 2 17 62 48 11 1 1 0 0 1 9 50 61 21 3 1 0 0 0 2 15 33 19 4 1 0 0 1 15 75 72 19 3 1 0 0 1 10 68100 41 6 1 0 0 0 2 23 62 47 10 1 0 0 0 4 26 30 9 2 1 0 0 0 3 26 46 24 5 1 0 0 0 1 10 33 34 11 2 0 0 0 1 3 4 2 1 0 0 0 0 1 3 7 5 2 1 0 0 0 0 2 6 9 5 1 0 0 0 1 1 1 1 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 1: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 8 11 4 1 0 0 0 0 1 2 4 2 1 0 0 0 0 0 0 0 0 0 0 0 0 1 3 20 33 12 2 0 0 0 0 1 4 11 6 1 0 0 0 0 0 0 1 1 1 0 0 0 0 2 12 28 14 3 0 0 0 0 1 3 11 8 2 0 0 0 0 0 0 1 1 1 0 0 0 0 0 3 9 8 2 0 0 0 0 0 1 4 5 2 0 0 0 0 0 0 1 1 1 0 0 0 0 0 1 2 3 1 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 256.91 Thresh = 0.020 Blend = F #Contributing = 38 InitialProfileWt = 0.053 Region 2 Sum = 362246; Maximum = 33974.8; FM = 0.779 !Region 2: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 1 0 0 0 0 0 0 5 19 7 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 0 0 7 31 14 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 2 11 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 2: Section 4->6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 2 1 0 0 0 0 0 0 9 37 13 1 0 0 0 0 0 8 42 13 0 0 0 0 0 0 5 30 10 0 0 0 0 0 0 17 76 30 1 0 0 0 0 0 26100 33 1 0 0 0 0 0 21 76 26 1 0 0 0 0 0 6 29 9 0 0 0 0 0 0 12 43 14 1 0 0 0 0 0 11 37 15 1 0 0 0 0 0 1 2 1 0 0 0 0 0 0 1 3 1 0 0 0 0 0 0 1 4 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 2: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 11 5 0 0 0 0 0 0 0 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 9 30 13 1 0 0 0 0 0 2 5 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 17 9 1 0 0 0 0 0 1 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 112.94 Thresh = 0.020 Blend = F #Contributing = 33 InitialProfileWt = 0.069 Region 3 Sum = 78759.6; Maximum = 6681.57; FM = 0.799 !Region 3: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 0 0 3 9 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 0 0 5 22 10 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 1 0 0 0 0 0 0 5 20 8 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 3: Section 4->6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 13 6 0 0 0 0 0 0 3 8 3 0 0 0 0 0 0 1 2 1 0 0 0 0 0 1 15 51 19 1 0 0 0 0 1 15 52 17 1 0 0 0 0 0 6 22 7 0 0 0 0 0 1 19 70 24 1 0 0 0 0 1 28100 31 1 0 0 0 0 0 16 60 18 1 0 0 0 0 0 7 30 9 1 0 0 0 0 0 15 58 17 1 0 0 0 0 0 12 48 16 1 0 0 0 0 0 1 4 2 0 0 0 0 0 0 3 11 4 0 0 0 0 0 0 4 14 6 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 3: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 16 5 0 0 0 0 0 0 1 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 6 21 9 1 0 0 0 0 0 2 6 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 10 6 1 0 0 0 0 0 1 4 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 3 1 0 0 0 0 0 1 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 67.87 Thresh = 0.020 Blend = F #Contributing = 12 InitialProfileWt = 0.344 Region 4 Sum = 22581; Maximum = 1186.11; FM = 0.796 !Region 4: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 5 4 1 0 0 0 0 0 1 9 9 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 8 11 2 0 0 0 0 0 1 17 28 8 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 10 4 1 0 0 0 0 1 11 33 15 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 3 1 1 1 0 0 1 4 17 13 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 1 1 0 0 0 1 3 4 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 4: Section 4->6 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 6 8 2 1 0 0 0 0 0 1 3 2 1 1 0 0 0 0 0 1 1 1 1 0 0 0 1 12 27 11 1 0 0 0 0 0 3 12 8 2 1 1 0 0 0 1 3 4 1 1 1 0 0 1 10 42 30 4 0 0 0 0 0 4 31 44 9 1 0 0 0 0 2 15 34 9 1 1 0 0 1 4 31 44 13 1 1 0 0 0 3 38100 40 3 1 0 0 0 1 26 94 44 4 1 0 0 0 1 8 25 14 2 1 0 0 0 1 15 77 53 7 1 0 0 0 1 13 82 65 10 1 0 0 0 1 1 5 5 1 1 0 0 0 0 3 19 22 5 1 0 0 0 0 3 23 30 8 1 0 0 0 0 1 1 1 0 0 0 0 0 0 1 2 3 1 1 0 0 0 0 1 3 5 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 1 0 0 !Region 4: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 10 3 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 7 29 16 2 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 29 28 6 1 0 0 0 0 0 2 4 2 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 10 17 7 1 0 0 0 0 0 1 5 4 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 2 5 4 1 0 0 0 0 0 1 3 4 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 40.70 Thresh = 0.020 Blend = F #Contributing = 8 InitialProfileWt = 0.393 Region 5 Sum = 11581.3; Maximum = 575.984; FM = 0.853 !Region 5: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 4 2 1 0 0 0 0 0 1 3 3 1 1 1 0 0 0 0 1 2 0 0 0 0 0 0 1 5 7 3 1 1 0 0 0 1 6 11 6 2 1 0 0 0 0 0 1 1 0 0 0 0 0 0 3 7 5 2 1 1 1 1 0 5 15 17 7 1 1 1 1 0 0 0 0 0 0 0 0 0 0 1 3 4 2 1 1 1 0 0 2 8 17 12 4 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 1 0 0 0 0 0 2 5 6 3 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 1 0 0 0 1 0 0 1 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 !Region 5: Section 4->6 0 0 0 1 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 1 1 0 0 0 0 1 1 2 2 2 1 0 0 0 0 1 1 1 1 1 0 0 0 3 12 15 5 2 0 0 0 0 1 9 17 7 3 1 0 0 0 1 3 7 4 2 1 0 0 0 3 20 53 33 7 1 1 0 1 2 18 66 50 13 2 1 0 1 1 7 27 27 11 3 1 0 0 1 13 61 64 23 3 1 0 0 1 12 80100 46 8 1 0 0 1 5 34 57 41 12 2 0 0 0 3 20 34 21 4 1 0 0 0 3 26 56 45 12 1 0 0 0 2 12 34 45 20 3 0 0 0 1 2 4 4 2 1 0 0 0 1 3 7 11 5 1 0 0 0 1 2 5 13 10 3 1 0 1 1 1 1 1 1 0 0 0 0 1 1 1 1 1 0 0 0 0 0 1 1 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 5: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 2 5 4 3 1 0 0 0 0 0 1 1 2 1 0 0 0 0 0 0 0 0 1 0 0 1 1 3 13 18 9 2 0 0 1 0 1 2 3 4 2 1 0 0 0 0 1 1 1 1 0 0 1 1 2 9 23 19 5 1 0 0 1 1 2 6 9 4 1 0 0 0 0 0 1 1 1 0 0 0 1 1 2 8 12 6 1 0 0 0 1 1 3 7 4 1 0 0 0 0 0 0 1 1 0 0 0 0 1 1 2 4 3 0 0 0 0 1 1 1 2 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 45.03 Thresh = 0.020 Blend = F #Contributing = 6 InitialProfileWt = 0.513 Region 6 Sum = 8926.33; Maximum = 389.723; FM = 0.819 !Region 6: Section 1->3 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 0 1 1 0 0 1 1 1 1 1 1 1 0 0 1 1 1 1 1 1 1 0 1 2 1 0 0 0 1 1 0 2 3 2 1 0 0 1 1 0 1 3 4 4 2 1 1 1 0 1 2 2 1 1 1 0 0 0 2 5 5 3 1 1 1 1 0 1 6 15 22 12 4 1 1 0 0 1 1 1 1 1 1 1 0 1 2 4 4 3 2 1 1 0 1 4 17 37 26 10 2 1 0 0 0 1 1 1 1 1 1 0 0 1 1 2 2 1 1 1 0 0 1 6 18 15 6 2 1 0 0 0 0 1 1 1 1 0 0 1 1 0 1 1 1 1 1 0 0 1 1 3 3 2 1 1 1 0 0 0 0 1 1 1 1 0 0 0 0 1 1 1 1 1 0 0 1 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 1 0 0 0 0 0 0 0 0 0 0 !Region 6: Section 4->6 0 0 0 1 1 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 2 1 1 0 1 1 1 1 1 1 1 0 0 0 1 1 0 0 1 1 0 0 0 3 8 12 6 3 2 1 0 0 2 7 11 7 3 2 0 0 0 1 2 4 3 2 1 1 0 1 5 30 60 38 11 3 1 1 1 3 23 54 39 14 4 1 0 0 1 5 15 18 12 6 1 0 1 5 36100 78 30 5 2 1 1 3 27 86 79 39 10 2 1 1 1 6 22 35 34 21 5 1 0 1 14 48 43 19 4 2 0 0 1 11 40 44 26 8 2 0 0 1 3 10 20 24 19 6 1 0 1 2 7 7 4 2 1 1 0 1 2 6 7 5 2 1 0 1 1 1 2 4 5 5 2 0 0 1 1 1 2 1 0 1 1 0 1 1 1 2 1 0 1 0 0 1 0 0 1 1 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 6: Section 7->9 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 1 1 0 0 0 0 1 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 2 2 1 0 0 0 0 1 1 1 1 1 0 0 0 0 0 1 0 0 0 0 0 1 1 3 6 9 8 2 0 0 1 1 2 2 3 4 1 0 0 0 0 1 1 1 0 0 0 1 1 2 4 12 26 31 9 1 0 1 1 2 3 10 16 5 1 0 0 0 1 1 1 1 1 0 0 1 1 2 7 18 29 12 2 0 1 1 1 2 7 16 7 1 0 0 0 1 1 1 2 1 0 1 1 1 1 2 5 7 4 1 1 1 1 1 1 3 4 3 0 0 1 0 0 0 1 1 0 0 0 0 0 0 1 2 2 1 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 47.03 Thresh = 0.020 Blend = F #Contributing = 12 InitialProfileWt = 0.263 Region 7 Sum = 14071.3; Maximum = 680.867; FM = 0.852 !Region 7: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 2 2 1 1 0 0 0 1 1 1 1 0 0 0 0 0 2 3 2 1 1 0 0 0 0 2 8 14 9 3 1 0 0 0 2 2 1 0 1 0 0 0 1 5 5 2 1 1 0 0 0 1 5 17 29 20 6 1 0 0 0 1 1 1 1 1 0 0 0 0 2 2 1 1 1 0 1 0 0 2 9 18 12 3 1 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 1 2 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 7: Section 4->6 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 1 1 0 0 1 1 1 1 1 1 1 0 0 0 0 1 1 1 1 0 0 0 1 2 6 6 3 2 1 0 0 1 2 6 8 5 2 1 0 0 0 0 2 4 4 3 1 0 0 2 16 41 42 18 4 1 0 0 2 11 41 54 30 9 2 0 0 1 2 12 23 25 15 3 0 1 4 32 87 81 31 6 1 0 0 3 23 85100 48 12 2 1 0 1 5 26 41 40 22 4 1 1 2 18 54 45 15 3 1 0 1 2 13 51 51 21 4 2 0 0 1 3 15 20 16 8 3 0 0 1 3 7 6 3 1 1 0 0 0 2 7 7 4 2 1 0 0 0 1 2 3 3 2 1 0 0 0 1 1 1 1 1 0 0 0 0 1 1 1 1 1 1 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 7: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 1 0 0 0 1 1 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 3 1 0 0 0 0 1 1 1 2 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 5 17 17 4 1 0 1 1 1 2 6 8 2 1 0 0 0 0 0 1 1 1 0 0 0 1 3 8 28 27 6 1 0 0 1 2 3 11 14 4 1 0 0 0 0 0 1 2 1 0 0 0 0 1 4 11 11 4 1 0 0 0 1 2 4 6 3 1 0 0 0 0 0 0 1 1 0 0 0 0 1 1 2 2 2 0 0 0 0 0 1 1 2 2 0 0 0 0 0 0 0 0 1 0 0 0 0 0 1 1 1 1 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 75.20 Thresh = 0.020 Blend = F #Contributing = 9 InitialProfileWt = 0.301 Region 8 Sum = 29247.3; Maximum = 1670.87; FM = 0.821 !Region 8: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 1 1 1 0 0 1 3 8 5 2 1 1 0 0 0 0 0 0 0 0 0 0 0 1 6 10 4 1 0 0 0 0 2 15 33 15 2 1 0 0 0 0 0 0 0 0 0 0 0 0 1 6 9 3 1 0 0 0 0 2 16 28 11 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 1 0 0 0 0 1 3 4 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 8: Section 4->6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 1 1 1 0 0 0 0 1 2 6 5 1 1 0 0 0 0 2 17 19 4 1 0 0 0 0 2 17 23 5 1 0 0 0 3 14 30 16 3 1 0 0 0 1 18 82 57 9 1 0 0 0 1 13 77 66 12 1 0 0 1 12 42 47 16 2 0 0 0 1 4 38100 49 7 1 0 0 0 2 23 85 52 9 1 0 0 1 12 31 24 6 1 0 0 0 1 3 23 41 15 2 1 0 0 0 1 13 31 14 3 1 0 0 0 2 5 4 1 1 0 0 0 0 1 4 6 2 1 0 0 0 0 1 2 5 2 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 8: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 5 9 3 1 0 0 0 0 0 0 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 3 21 25 7 1 0 0 0 0 0 1 3 3 1 0 0 0 0 0 0 1 1 0 0 0 0 1 4 20 18 5 1 0 0 0 1 1 1 2 2 1 0 0 0 0 0 0 1 1 0 0 0 0 0 2 6 5 2 1 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 1 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 145.03 Thresh = 0.020 Blend = F #Contributing = 32 InitialProfileWt = 0.090 Region 9 Sum = 103010; Maximum = 8646.87; FM = 0.81 !Region 9: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 0 0 1 7 10 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 5 1 0 0 0 0 0 2 16 28 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 3 1 0 0 0 0 0 1 8 15 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 9: Section 4->6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 0 0 2 6 2 0 0 0 0 0 0 1 6 3 0 0 0 0 0 1 16 36 7 1 0 0 0 0 1 18 57 15 1 0 0 0 0 0 11 45 18 1 0 0 0 0 3 35 75 19 1 0 0 0 0 2 36100 31 2 0 0 0 0 1 18 64 27 2 0 0 0 0 1 15 35 11 1 0 0 0 0 1 13 40 16 1 0 0 0 0 0 5 22 12 2 0 0 0 0 0 2 4 2 0 0 0 0 0 0 1 4 2 0 0 0 0 0 0 1 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 9: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 3 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 22 12 1 0 0 0 0 0 2 6 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 23 15 2 0 0 0 0 0 2 6 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 6 6 2 0 0 0 0 0 0 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 ................ Refinement, sample 1 of 1 -- single-component data This sample is a single crystal with 3 indices (HKL) Orientation LS for Sample 1 of 1, component 1 in sample, 1 in .p4p/.spin file (204 input reflections)... Frame rows, columns: 1024 1536 Frame width (deg): 1.000 Relative SVD-filter threshold: 0.0000500 Starting gradient-expansion term: 0.0020000 Weighting multiplier for Z terms: 1.0000000 Minimum elements to filter: 0 Maximum number of LS cycles: 25 Vertical tilt of beam (deg): 0.2200 Individual reflection weights will be used in the refinement Wavelength, relative uncertainty: 1.5418400, 0.0000058 Component numbers S.C(F) below: S=sample, C=component in sample, F=component in file Reflection Summary: Component Input RLV.Excl Used WorstRes BestRes Min.2Th Max.2Th 1.1(1) 204 0 204 8.6907 0.8886 10.178 120.346 Orientation ('UB') matrix: 0.1441745 0.0357226 -0.0039185 0.0297840 -0.0024446 0.0772184 0.0657591 -0.0772133 -0.0042576 A B C Alpha Beta Gamma Vol 6.2446 11.7493 13.0027 90.000 96.692 90.000 947.49 0.0006 0.0006 0.0021 0.000 0.007 0.000 0.22 Corrected for goodness of fit: 0.0012 0.0013 0.0046 0.000 0.015 0.000 0.49 Crystal system constraint: 3 (Monoclinic B-uniq) Parameter constraint mask: T (512 = 200[hex]) T: Crystal Translations Eulerian angles (deg): 9.016 95.924 24.207 Goniometer zeros (deg): 0.0000* 0.0329 0.0000* 0.0197 (*=never refined) Crystal translations (pixels): 0.0000 0.0000 0.0000 Detector corrections: X-Cen Y-Cen Dist Pitch Roll Yaw -4.1625 -0.2950 0.0744 -0.1267 -0.1449 0.8308 Refinement statistics: StartingRes FinalRes GOF #Cycles #Filtered Code 3.23590e+03 2.88506e+03 2.21 3 4 0 Overall statistics for terms in X, Y, and Z: X Y Z Number of nonzero-weight terms: 204 204 200 Average input ESD (pix, pix, deg): 0.21475 0.16136 0.05765 Goodness of fit: 2.90006 2.03139 1.27972 Old XYZ spot size: 2.253 2.321 2.129 New XYZ spot size: 2.222 2.289 2.099 Average missing volume: 0.037 % with too much missing I: 3.460 Fractional overlap in H,K,L: 0.000 0.000 0.000 Integration ============================= 10/26/2021 10:23:27 Unsorted reflections will be written to /smb/isengard/data/neal054/work/unsorted.raw Spatially corrected beam center: 773.94 507.14 Input monochromator 2Th, roll (deg): 0.00 0.00 Input spot-size bias: 1.000 Unbiased XYZ spot size (deg): 2.222 2.289 2.099 Spot size used (deg): 2.222 2.289 2.099 Scale for orientation update length: 1.00000 #Frames running average for orientation update: 13 Frames between full refinements of orientation: 50 N, where every Nth strong spot included in LS: 1 LS profile fitting will be used to worst resolution of 9999.000 A up to I/sigma(I) of 8.000 unweighted fit Accurate-timing indicator is set in the frame headers: Velocity normalization will be computed for each frame Pixel spacing (deg): 0.129 Profile X,Y,Z spacing (deg): 0.310 0.264 0.313 Profile convolver halfwidth: 1.00 1.00 1.88 Background pixels updated = 92.96% Port, connections: 2000, 1 Integration of neal054 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 0_0001 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 17 0.00 0.00 0.00 1.000 1_0002 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 16 0.00 0.00 0.00 1.000 2_0003 3 0.02 0.07 -0.00 0.07 0.08 0.03 28693 31 0 0.54 23 2.81 2.39 3.74 1.000 3_0004 8 -0.04 0.02 -0.02 0.49 0.22 0.08 36750 44 0 0.76 27 3.00 3.03 3.43 1.000 4_0005 10 0.21 0.03 -0.00 0.35 0.15 0.06 68459 87 0 0.80 33 2.60 3.01 3.65 1.000 5_0006 13 -0.06 0.00 0.01 0.18 0.14 0.07 63368 69 0 0.77 27 2.25 2.51 3.64 1.000 6_0007 9 0.53 -0.23 -0.07 1.18 1.43 0.23 56489 69 0 0.82 27 2.20 2.46 3.64 1.000 7_0008 12 0.08 0.01 0.02 0.22 0.12 0.18 27200 37 0 0.82 27 2.19 2.36 3.50 1.000 8_0009 5 -0.06 0.01 0.01 0.10 0.07 0.03 104631 102 0 0.90 35 2.14 2.38 3.49 1.000 9_0010 6 0.53 0.08 0.00 1.31 0.13 0.07 56994 65 0 0.64 25 2.16 2.38 3.53 1.000 10_0011 13 0.07 -0.00 -0.02 0.15 0.16 0.07 49570 68 0 0.79 29 2.19 2.44 3.55 1.000 11_0012 11 0.24 -0.04 -0.02 0.49 0.15 0.09 49247 55 0 0.75 26 2.21 2.40 3.54 1.000 12_0013 7 0.04 -0.02 -0.00 0.15 0.10 0.04 40626 45 14 0.68 26 2.18 2.38 3.52 1.000 13_0014 9 -0.13 -0.06 0.04 0.32 0.24 0.09 27859 58 0 0.79 28 2.14 2.33 3.49 1.000 14_0015 12 0.06 -0.09 -0.04 0.49 0.31 0.12 49473 60 0 0.80 28 2.21 2.37 3.46 1.000 15_0016 10 -0.02 -0.02 -0.00 0.11 0.06 0.06 67253 73 0 0.85 27 2.18 2.37 3.45 1.000 16_0017 5 -0.19 0.06 0.02 0.36 0.14 0.12 47867 83 0 0.75 33 2.17 2.37 3.45 1.000 17_0018 12 0.00 -0.01 -0.00 0.10 0.04 0.05 73843 82 0 0.83 26 2.13 2.35 3.44 1.000 18_0019 12 0.05 -0.07 -0.00 0.22 0.16 0.07 67977 67 0 0.74 27 2.13 2.35 3.42 1.000 19_0020 9 -0.04 -0.02 -0.02 0.09 0.08 0.04 69544 78 0 0.76 26 2.11 2.35 3.40 1.000 Background pixels updated = 93.24% Port, connections: 2000, 1 Integration of neal054 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 20_0021 9 0.28 -0.15 -0.04 0.72 0.34 0.14 50086 54 11 0.75 27 2.10 2.34 3.40 1.000 21_0022 4 0.07 -0.06 -0.07 0.22 0.14 0.18 14716 28 0 0.86 24 2.10 2.33 3.39 1.000 22_0023 6 0.15 0.59 -0.13 0.26 1.50 0.31 33228 40 0 0.77 28 2.09 2.32 3.38 1.000 23_0024 11 -0.06 0.00 0.02 0.18 0.17 0.08 69017 67 0 0.76 27 2.06 2.32 3.38 1.000 24_0025 9 0.31 -0.06 -0.05 0.94 0.09 0.16 142720 121 0 0.78 28 2.05 2.34 3.39 1.000 25_0026 10 -0.02 -0.04 0.00 0.34 0.16 0.11 23248 36 0 0.79 27 2.05 2.34 3.38 1.000 26_0027 6 0.10 -0.08 -0.27 0.28 0.13 0.63 67900 67 0 0.83 22 2.03 2.33 3.39 1.000 27_0028 11 -0.26 -0.04 0.01 0.87 0.08 0.11 54090 64 0 0.84 30 2.01 2.33 3.38 1.000 28_0029 7 0.01 -0.03 0.01 0.08 0.06 0.07 54828 76 0 0.79 24 1.99 2.31 3.39 1.000 29_0030 13 0.03 -0.04 -0.06 0.12 0.09 0.08 48195 61 0 0.77 29 1.99 2.31 3.38 1.000 30_0031 10 0.27 -0.00 -0.03 0.68 0.05 0.06 47737 57 0 0.75 25 1.99 2.29 3.39 1.000 31_0032 5 -0.34 0.01 0.05 0.63 0.23 0.14 71691 84 0 0.85 39 1.98 2.30 3.39 1.000 32_0033 11 0.03 -0.05 0.03 0.10 0.07 0.13 102170 90 0 0.82 25 1.97 2.31 3.40 1.000 33_0034 8 0.14 -0.05 -0.02 0.35 0.13 0.07 56988 53 0 0.76 26 1.95 2.29 3.40 1.000 34_0035 3 2.64 -0.29 0.07 3.56 0.64 0.21 10343 21 0 0.76 20 1.95 2.29 3.39 1.000 35_0036 13 -0.01 -0.03 -0.05 0.35 0.22 0.09 64495 82 8 0.75 28 1.96 2.32 3.39 1.000 36_0037 7 0.03 -0.03 -0.03 0.10 0.06 0.06 64331 78 0 0.77 25 1.94 2.30 3.41 1.000 37_0038 11 0.14 -0.08 -0.03 0.23 0.25 0.08 39645 51 0 0.83 28 1.95 2.31 3.41 1.000 38_0039 10 0.16 -0.15 -0.07 0.43 0.43 0.08 62364 76 0 0.74 25 1.94 2.30 3.42 1.000 39_0040 9 -0.03 -0.01 -0.03 0.10 0.07 0.06 75514 83 0 0.87 26 1.94 2.31 3.43 1.000 Background pixels updated = 92.99% Port, connections: 2000, 1 Integration of neal054 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 40_0041 11 0.08 -0.07 -0.05 0.14 0.12 0.07 64551 76 0 0.81 28 1.94 2.33 3.43 1.000 41_0042 8 0.64 -0.03 -0.10 1.25 0.76 0.15 56462 53 0 0.72 26 1.94 2.34 3.43 1.000 42_0043 10 0.04 -0.09 -0.08 0.16 0.20 0.10 46140 52 0 0.76 26 1.95 2.35 3.43 1.000 43_0044 10 0.67 -0.46 -0.10 2.09 1.29 0.13 41453 57 0 0.74 27 1.95 2.35 3.42 1.000 44_0045 8 0.08 -0.19 -0.04 0.58 0.52 0.19 10564 22 0 0.76 30 1.95 2.35 3.41 1.000 45_0046 4 0.22 -0.09 -0.15 0.32 0.20 0.22 94452 78 25 0.75 27 1.96 2.36 3.42 1.000 46_0047 10 0.11 -0.02 -0.08 0.17 0.15 0.10 43985 58 0 0.83 27 1.95 2.35 3.41 1.000 47_0048 8 0.11 -0.08 -0.08 0.25 0.16 0.10 60262 67 0 0.67 26 1.95 2.36 3.40 1.000 48_0049 17 0.06 -0.12 -0.08 0.16 0.26 0.10 67306 71 0 0.76 25 1.95 2.37 3.41 1.000 49_0050 11 0.03 -0.00 -0.12 0.20 0.14 0.13 160438 152 0 0.81 31 1.95 2.38 3.42 1.000 ................ Refinement, sample 1 of 1 -- single-component data This sample is a single crystal with 3 indices (HKL) Orientation LS for Sample 1 of 1, component 1 in sample, 1 in .p4p/.spin file (397 input reflections)... Frame rows, columns: 1024 1536 Frame width (deg): 1.000 Relative SVD-filter threshold: 0.0000500 Starting gradient-expansion term: 0.0020000 Weighting multiplier for Z terms: 1.0000000 Minimum elements to filter: 0 Maximum number of LS cycles: 25 Vertical tilt of beam (deg): 0.2200 Individual reflection weights will be used in the refinement Wavelength, relative uncertainty: 1.5418400, 0.0000058 Component numbers S.C(F) below: S=sample, C=component in sample, F=component in file Reflection Summary: Component Input RLV.Excl Used WorstRes BestRes Min.2Th Max.2Th 1.1(1) 397 0 397 8.6915 0.8798 10.177 122.394 Orientation ('UB') matrix: 0.1441288 0.0357237 -0.0038824 0.0298651 -0.0024309 0.0771954 0.0657346 -0.0772229 -0.0042260 A B C Alpha Beta Gamma Vol 6.2468 11.7481 13.0088 90.000 96.757 90.000 948.06 0.0003 0.0004 0.0009 0.000 0.003 0.000 0.11 Corrected for goodness of fit: 0.0007 0.0009 0.0021 0.000 0.006 0.000 0.27 Crystal system constraint: 3 (Monoclinic B-uniq) Parameter constraint mask: T (512 = 200[hex]) T: Crystal Translations Eulerian angles (deg): 9.049 95.928 24.203 Goniometer zeros (deg): 0.0000* 0.0338 0.0000* 0.0260 (*=never refined) Crystal translations (pixels): 0.0000 0.0000 0.0000 Detector corrections: X-Cen Y-Cen Dist Pitch Roll Yaw -4.2104 -0.2685 0.0729 -0.1445 -0.1592 0.8436 Refinement statistics: StartingRes FinalRes GOF #Cycles #Filtered Code 9.24847e+03 6.78128e+03 2.41 3 4 0 Overall statistics for terms in X, Y, and Z: X Y Z Number of nonzero-weight terms: 397 397 391 Average input ESD (pix, pix, deg): 0.21106 0.16371 0.05455 Goodness of fit: 2.93268 2.47250 1.55041 Background pixels updated = 92.80% Port, connections: 2000, 1 Integration of neal054 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 50_0051 8 -0.02 0.04 -0.09 0.41 0.08 0.14 40395 45 0 0.76 26 1.95 2.39 3.42 1.000 51_0052 8 0.35 0.11 -0.10 0.82 0.20 0.13 89488 97 0 0.77 28 1.95 2.39 3.42 1.000 52_0053 5 0.02 0.10 -0.06 0.06 0.14 0.07 50703 72 0 0.86 29 1.95 2.40 3.43 1.000 53_0054 11 -0.12 0.04 -0.01 0.46 0.15 0.11 28207 44 0 0.78 25 1.96 2.40 3.41 1.000 54_0055 9 -0.06 0.01 -0.06 0.19 0.14 0.08 65753 65 0 0.72 27 1.96 2.41 3.41 1.000 55_0056 11 0.22 0.07 -0.08 0.55 0.31 0.09 33182 46 0 0.75 25 1.96 2.42 3.41 1.000 56_0057 12 0.06 0.07 -0.07 0.15 0.12 0.09 29667 41 8 0.77 26 1.96 2.43 3.41 1.000 57_0058 9 -0.00 0.11 -0.09 0.45 0.22 0.15 105866 90 0 0.76 27 1.96 2.43 3.43 1.000 58_0059 10 0.19 -0.03 -0.10 0.53 0.25 0.13 33216 46 0 0.77 27 1.97 2.45 3.43 1.000 59_0060 5 -0.00 0.07 -0.04 0.11 0.13 0.09 15967 26 0 0.71 28 1.97 2.45 3.42 1.000 Background pixels updated = 93.07% Port, connections: 2000, 1 Integration of neal054 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 60_0061 10 -0.11 0.10 -0.09 0.19 0.13 0.12 42911 62 0 0.83 26 1.96 2.45 3.43 1.000 61_0062 9 0.08 0.10 -0.10 0.14 0.14 0.16 55217 56 0 0.77 25 1.97 2.46 3.43 1.000 62_0063 11 0.45 0.05 -0.11 1.27 0.38 0.16 16033 26 0 0.70 28 1.96 2.46 3.43 1.000 63_0064 10 -0.10 0.02 -0.08 0.39 0.23 0.11 71233 91 0 0.84 25 1.97 2.47 3.43 1.000 64_0065 10 0.08 0.05 -0.05 0.20 0.13 0.09 31723 45 0 0.78 27 1.97 2.47 3.43 1.000 65_0066 7 0.16 -0.02 -0.10 0.30 0.05 0.10 70613 69 0 0.71 25 1.98 2.48 3.43 1.000 66_0067 7 0.16 0.01 -0.06 0.21 0.05 0.09 74893 63 0 0.71 26 1.98 2.48 3.44 1.000 67_0068 11 0.05 -0.04 -0.06 0.13 0.06 0.10 84106 100 0 0.79 30 1.98 2.49 3.43 1.000 68_0069 9 0.30 -0.10 -0.08 0.52 0.27 0.16 25577 38 0 0.69 27 1.98 2.49 3.43 1.000 69_0070 11 0.08 -0.14 -0.06 0.26 0.31 0.10 61250 68 0 0.76 27 1.98 2.50 3.43 1.000 70_0071 4 -0.04 -0.00 -0.03 0.08 0.04 0.08 192416 179 0 0.88 30 1.98 2.51 3.44 1.000 71_0072 12 0.31 -0.04 -0.08 0.64 0.40 0.14 51574 58 0 0.75 25 1.98 2.51 3.44 1.000 72_0073 15 0.03 -0.14 -0.07 0.46 0.20 0.13 49403 55 13 0.75 28 1.97 2.52 3.44 1.000 73_0074 7 0.08 -0.04 -0.04 0.23 0.18 0.11 62728 82 0 0.82 29 1.98 2.53 3.44 1.000 74_0075 8 0.56 -0.33 -0.12 1.54 0.77 0.30 87357 83 0 0.73 26 1.97 2.53 3.44 1.000 75_0076 12 0.10 -0.08 -0.00 0.39 0.20 0.06 48044 68 0 0.78 26 1.97 2.53 3.43 1.000 76_0077 9 0.14 -0.06 -0.03 0.23 0.11 0.09 68213 79 0 0.81 33 1.97 2.54 3.44 1.000 77_0078 13 0.15 -0.02 -0.08 0.48 0.26 0.14 42113 49 8 0.69 31 1.98 2.55 3.44 1.000 78_0079 7 0.45 -0.11 -0.05 1.08 0.15 0.11 186636 137 0 0.75 26 1.98 2.55 3.46 1.000 79_0080 2 0.09 -0.13 -0.14 0.20 0.17 0.23 32615 49 0 0.81 24 1.98 2.55 3.45 1.000 Background pixels updated = 92.80% Port, connections: 2000, 1 Integration of neal054 # File #Ref ErrX ErrY ErrZ RmsX RmsY RmsZ Inorm #Sig %<2s %Ful XSiz YSiz ZSiz Beam 80_0081 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 17 1.98 2.55 3.45 1.000 81_0082 0 0.00 0.00 0.00 0.00 0.00 0.00 0 0 0 0.00 17 1.98 2.55 3.45 1.000 Requested number of frames processed: /smb/isengard/data/neal054/neal054_06_0082.sfrm I/Sigma = 79.98 Thresh = 0.020 Blend = F #Contributing = 230 InitialProfileWt = 0.000 Region 1 Sum = 36995.7; Maximum = 1132.82; FM = 0.846 !Region 1: Section 1->3 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 1 1 1 0 0 0 0 0 0 1 3 3 1 0 0 0 0 0 1 5 9 3 1 0 0 0 0 1 1 1 0 0 0 0 0 0 2 7 8 2 1 1 0 0 0 2 16 29 10 2 1 0 0 0 1 1 1 0 0 0 0 0 0 2 8 13 4 1 1 0 0 0 3 23 52 23 3 1 0 0 0 0 1 0 0 0 0 0 0 0 1 6 11 4 1 1 0 0 0 2 18 54 30 5 1 1 0 0 0 0 0 0 0 0 0 0 0 1 2 4 2 1 1 0 0 0 1 6 20 13 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 1 4 4 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 1 2 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 1: Section 4->6 0 0 1 2 1 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 1 1 1 0 0 0 0 1 5 12 6 2 1 0 0 0 0 2 8 7 3 1 0 0 0 0 1 3 7 5 2 0 0 0 2 16 43 24 4 1 0 0 0 1 7 29 30 11 2 0 0 0 0 2 10 27 20 5 1 0 0 2 24 81 52 9 2 0 0 0 1 10 59 71 28 4 1 0 0 1 3 23 67 51 11 1 0 0 2 22 91 71 15 2 1 0 0 1 11 68100 45 6 1 0 0 1 3 28 94 77 16 2 0 0 1 8 37 34 9 1 1 0 0 1 4 30 55 30 5 1 0 0 1 1 13 55 54 15 2 0 0 0 2 8 10 4 1 1 0 0 0 1 8 19 13 3 1 0 0 0 1 5 22 27 11 2 0 0 0 1 2 4 2 1 0 0 0 0 1 2 8 7 2 1 0 0 0 0 2 9 15 8 2 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 2 3 2 1 0 !Region 1: Section 7->9 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 4 4 2 1 0 0 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 3 14 16 5 1 0 0 0 0 1 2 4 2 1 0 0 0 0 0 0 0 1 0 0 0 1 1 7 33 39 12 2 0 0 0 1 1 5 10 5 1 0 0 0 0 0 1 1 1 0 0 0 1 1 8 46 57 18 3 1 0 0 1 2 7 16 8 2 0 0 0 0 0 1 1 1 1 0 0 0 1 5 28 41 19 4 1 0 0 1 1 5 13 9 3 1 0 0 0 0 1 1 2 1 0 0 0 1 2 12 25 16 5 1 0 0 1 1 3 10 10 4 1 0 0 0 0 0 2 2 2 1 0 0 1 1 6 17 14 5 1 0 0 0 1 2 9 10 4 1 0 0 0 0 1 2 3 2 1 0 0 0 0 1 4 5 2 0 0 0 0 0 1 3 4 2 0 0 0 0 0 0 1 1 1 0 I/Sigma = 271.13 Thresh = 0.020 Blend = F #Contributing = 162 InitialProfileWt = 0.000 Region 2 Sum = 362311; Maximum = 25671.9; FM = 0.786 !Region 2: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 2 7 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 6 1 0 0 0 0 0 0 9 33 11 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 7 2 0 0 0 0 0 0 13 55 20 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 0 0 0 0 0 0 0 5 22 5 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 2: Section 4->6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 9 3 0 0 0 0 0 0 2 7 2 0 0 0 0 0 0 1 6 2 0 0 0 0 0 1 14 54 19 0 0 0 0 0 0 12 50 17 0 0 0 0 0 0 9 46 14 0 0 0 0 0 1 24100 40 1 0 0 0 0 1 26 93 34 1 0 0 0 0 0 26 83 26 1 0 0 0 0 0 10 44 11 0 0 0 0 0 0 11 41 13 0 0 0 0 0 0 11 38 15 1 0 0 0 0 0 1 3 1 0 0 0 0 0 0 1 5 2 0 0 0 0 0 0 2 7 4 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 2: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 5 25 8 0 0 0 0 0 0 1 4 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 14 47 15 1 0 0 0 0 0 3 9 4 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 7 24 11 1 0 0 0 0 0 2 6 4 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 6 4 1 0 0 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 160.84 Thresh = 0.020 Blend = F #Contributing = 127 InitialProfileWt = 0.000 Region 3 Sum = 142625; Maximum = 11264.3; FM = 0.827 !Region 3: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 3 7 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 5 17 8 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 1 0 0 0 0 0 0 5 20 9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 3 9 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 3: Section 4->6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 1 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 4 15 7 1 0 0 0 0 0 4 14 7 1 0 0 0 0 0 2 6 4 1 0 0 0 0 1 11 48 22 1 0 0 0 0 1 12 59 29 1 0 0 0 0 0 6 31 17 1 0 0 0 0 1 18 69 28 1 0 0 0 0 1 25100 40 1 0 0 0 0 1 14 62 26 1 0 0 0 0 1 11 32 9 1 0 0 0 0 2 19 52 15 1 0 0 0 0 1 13 39 13 1 0 0 0 0 1 4 5 1 0 0 0 0 0 2 8 11 3 0 0 0 0 0 1 7 12 4 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 3 3 1 0 0 0 0 0 1 3 5 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 1 1 0 0 0 !Region 3: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 7 5 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 3 16 8 0 0 0 0 0 0 1 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 4 14 6 0 0 0 0 0 0 1 3 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 8 4 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 5 3 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 68.80 Thresh = 0.020 Blend = F #Contributing = 48 InitialProfileWt = 0.009 Region 4 Sum = 28048.1; Maximum = 1207.14; FM = 0.836 !Region 4: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 2 2 1 0 0 0 0 0 1 4 9 4 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 2 3 1 1 1 0 0 0 1 6 19 11 1 1 0 0 0 0 0 1 1 0 0 0 0 0 0 1 3 2 1 0 0 0 0 0 4 25 22 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 1 0 0 0 0 0 1 16 21 5 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 1 5 9 4 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 2 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 4: Section 4->6 0 0 1 3 2 0 0 0 0 0 0 1 3 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 1 6 21 10 1 0 0 0 0 1 4 18 9 1 0 0 0 0 0 1 5 3 1 0 0 0 0 1 8 48 34 3 0 0 0 0 1 6 44 33 4 1 0 0 0 1 2 13 13 3 1 1 0 0 0 7 69 69 10 1 1 0 0 1 6 67 77 14 1 1 0 0 1 2 23 37 12 1 1 0 0 0 3 49 75 19 2 1 0 0 0 3 53100 34 3 1 0 0 0 2 22 64 33 3 1 0 0 0 1 16 36 17 2 0 0 0 1 1 20 62 37 4 1 0 0 0 1 10 54 44 5 1 0 0 0 1 6 12 6 1 0 0 0 0 1 8 23 18 3 1 0 0 0 1 5 25 26 5 1 0 0 0 1 3 5 3 1 0 0 0 0 1 3 11 9 2 1 0 0 0 0 3 13 14 4 1 0 0 0 0 1 2 1 0 0 0 0 0 0 1 4 3 1 0 0 0 0 0 1 5 5 2 0 0 !Region 4: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 3 2 0 0 0 0 1 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 3 11 7 1 0 0 0 0 1 1 2 3 1 0 0 0 0 0 0 1 0 0 0 0 0 1 1 4 22 19 2 1 0 0 1 1 1 4 5 1 0 0 0 0 0 1 1 1 0 0 0 0 0 1 3 24 26 4 1 0 0 0 1 1 4 6 1 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 13 18 4 1 0 0 0 1 1 2 5 2 1 0 0 0 0 0 0 1 1 0 0 0 0 1 2 7 11 5 1 0 0 0 0 1 2 4 3 1 0 0 0 0 1 0 1 1 0 0 0 0 0 1 3 5 3 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 46.01 Thresh = 0.020 Blend = F #Contributing = 37 InitialProfileWt = 0.014 Region 5 Sum = 15191.9; Maximum = 619.858; FM = 0.87 !Region 5: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 1 1 0 0 1 0 0 3 3 1 1 0 0 1 1 0 4 5 2 1 0 0 0 0 0 1 1 1 0 0 0 0 0 1 4 5 3 1 1 0 1 0 1 6 14 11 3 1 0 1 0 0 1 1 0 1 0 0 1 0 0 2 5 5 2 1 1 1 0 0 3 15 22 9 2 1 1 0 0 1 0 0 0 0 0 1 0 0 1 2 3 2 1 1 1 0 0 1 6 18 13 3 1 1 0 0 0 0 1 0 1 0 1 0 0 1 1 1 2 1 1 1 0 0 1 1 5 6 3 1 1 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 0 1 0 0 0 1 1 1 2 1 1 0 0 0 0 0 1 0 0 0 0 0 0 1 0 1 1 0 0 0 0 0 1 0 0 1 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 5: Section 4->6 0 0 1 1 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 2 7 6 2 1 0 0 0 0 1 6 8 4 2 0 -1 0 0 0 2 4 2 1 0 0 0 0 4 21 28 13 3 0 0 0 0 2 17 37 22 6 0 0 0 0 1 5 17 14 5 0 0 0 0 2 24 60 39 11 1 0 0 0 1 19 73 64 23 3 0 0 0 1 6 32 39 20 3 0 0 0 1 11 55 59 23 3 0 0 0 1 10 70100 55 10 1 0 0 1 4 32 64 54 14 1 0 0 1 2 17 31 18 5 0 0 0 1 3 24 55 45 15 1 0 0 0 1 12 38 52 22 3 0 0 0 1 4 8 7 3 0 0 0 0 1 5 17 17 8 1 0 0 0 0 3 12 21 16 4 1 0 0 0 1 3 3 2 0 0 0 0 0 1 7 8 5 1 0 0 0 0 1 5 9 9 3 0 0 0 0 1 1 1 1 0 0 0 0 0 1 1 2 2 0 0 0 0 0 0 1 3 3 1 0 !Region 5: Section 7->9 0 0 1 0 1 0 0 0 0 0 0 1 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 1 1 1 1 1 1 1 0 0 0 0 0 1 1 0 0 0 0 1 0 2 3 2 1 1 0 0 1 1 1 1 1 1 1 1 0 1 0 0 0 0 0 1 0 0 1 1 3 9 9 3 1 0 0 1 1 1 2 3 2 1 1 0 0 0 1 1 1 1 1 0 0 0 1 4 16 27 10 2 0 0 0 0 1 3 7 5 2 1 0 0 0 0 1 1 1 1 0 0 0 1 2 11 31 17 3 1 0 0 1 1 3 8 7 3 1 0 0 0 0 1 1 1 1 0 0 0 0 1 4 13 15 5 1 0 0 0 1 2 4 6 3 1 0 0 0 0 1 1 1 1 0 0 0 0 0 2 5 10 5 0 0 0 0 0 1 2 5 3 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 2 3 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 46.38 Thresh = 0.020 Blend = F #Contributing = 29 InitialProfileWt = 0.027 Region 6 Sum = 14381.9; Maximum = 438.742; FM = 0.88 !Region 6: Section 1->3 0 0 0 0 0 0 0 0 0 0 1 1 1 0 0 1 0 0 0 1 1 1 0 0 0 0 0 0 1 1 0 0 1 0 0 0 1 3 3 1 0 1 1 0 0 1 3 4 3 1 0 0 0 0 1 2 2 1 0 0 1 0 0 2 6 8 3 1 1 1 0 0 1 9 15 13 6 2 1 0 0 1 2 2 1 1 1 1 0 0 2 7 10 7 3 2 1 0 0 2 9 24 30 17 4 1 0 0 0 1 1 1 1 1 1 1 0 1 3 7 7 3 2 1 1 0 1 4 21 37 23 7 2 0 0 0 0 1 1 1 1 0 1 0 0 1 2 3 2 1 1 1 0 0 1 7 15 12 4 1 1 0 0 0 1 0 1 0 0 0 0 1 1 1 1 1 1 1 1 1 1 1 2 4 4 2 1 1 0 0 0 0 0 0 1 0 0 0 0 1 1 1 1 1 1 1 1 0 1 1 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 6: Section 4->6 0 0 1 1 1 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 1 1 1 0 1 0 1 1 4 6 4 1 0 0 0 0 1 2 5 5 3 1 0 0 0 1 1 2 4 4 2 1 0 1 6 17 26 18 6 1 0 0 0 2 9 23 27 13 4 1 0 0 1 2 9 18 15 6 1 0 1 6 31 62 49 18 4 1 0 0 2 17 55 69 39 12 2 0 0 1 4 21 46 44 21 4 0 1 4 31 82 71 30 7 1 0 1 2 19 72100 66 24 4 0 1 1 5 27 68 77 42 7 1 0 1 10 34 37 16 5 1 0 0 1 7 32 53 37 16 3 1 1 1 2 13 37 45 31 8 1 0 1 1 7 10 5 3 1 0 0 1 1 7 16 13 7 2 1 0 1 0 3 12 17 15 6 1 0 1 0 1 2 2 1 1 0 0 1 0 2 5 5 4 2 0 0 1 0 1 5 8 9 5 1 0 0 0 0 1 1 1 0 0 0 0 0 1 1 1 2 1 0 0 0 0 1 2 2 3 2 1 !Region 6: Section 7->9 0 0 0 1 1 1 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 1 1 1 2 3 2 1 0 0 0 1 1 1 2 1 1 1 0 0 0 0 1 1 1 1 0 0 1 1 2 5 9 6 2 0 0 0 1 1 1 3 3 2 0 0 0 1 0 0 1 1 1 0 0 1 2 5 14 27 19 4 1 0 0 1 2 3 8 8 3 1 0 0 0 0 1 1 1 1 0 0 1 2 6 21 48 39 8 1 0 0 1 2 4 14 16 5 1 -1 0 0 1 1 1 2 2 0 1 1 1 3 12 30 33 11 2 0 1 0 1 3 10 16 7 2 0 0 0 0 1 2 3 2 1 1 1 0 1 5 13 19 11 2 1 0 0 1 2 5 10 9 2 0 0 0 1 1 1 2 3 1 0 0 1 1 2 6 12 10 3 1 0 1 1 1 3 7 9 3 0 0 1 0 1 1 2 4 2 0 0 0 1 1 2 4 5 2 0 0 1 0 0 1 2 4 2 0 0 1 0 0 1 0 2 1 I/Sigma = 60.02 Thresh = 0.020 Blend = F #Contributing = 43 InitialProfileWt = 0.008 Region 7 Sum = 20668.3; Maximum = 648.329; FM = 0.842 !Region 7: Section 1->3 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 1 0 0 0 0 0 0 0 1 1 1 0 1 0 0 0 0 0 1 1 2 3 2 1 0 0 0 1 1 0 0 0 0 0 0 1 2 2 1 1 0 0 0 0 1 2 5 11 9 4 1 0 0 0 1 2 1 0 0 0 0 0 1 3 5 3 1 0 0 0 0 1 4 15 27 20 7 1 1 0 1 2 2 1 0 0 0 0 0 2 5 5 4 2 0 0 0 0 1 5 21 39 27 8 1 1 0 0 1 1 1 1 0 0 0 0 1 2 2 2 1 1 0 1 0 0 2 10 19 13 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 3 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 7: Section 4->6 0 0 0 1 2 1 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 1 1 1 1 0 0 0 1 2 6 8 5 1 0 0 0 1 1 5 8 6 2 1 0 0 1 1 2 3 3 4 1 0 1 2 8 28 29 14 3 1 0 0 1 5 24 29 18 6 1 0 0 1 2 7 11 16 14 4 1 1 3 24 68 63 27 5 1 0 0 2 14 59 69 43 14 2 0 0 1 3 17 32 48 36 7 1 1 4 37100 83 30 5 1 0 0 2 24 88 92 47 13 3 0 0 1 6 27 43 54 37 8 1 0 2 21 51 40 12 2 1 1 0 1 15 45 44 20 6 2 1 0 1 4 14 21 26 21 8 2 0 1 3 8 9 4 1 1 0 0 1 3 8 10 7 3 1 0 0 1 1 3 6 13 12 7 2 0 1 1 2 2 1 1 0 0 0 1 1 2 3 2 1 1 0 0 1 1 1 3 6 7 4 1 0 0 1 1 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 1 1 1 1 0 !Region 7: Section 7->9 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 2 4 2 0 0 0 0 1 1 1 2 1 0 0 0 0 0 0 0 0 0 0 0 1 1 2 3 12 17 5 1 0 0 0 1 1 5 8 2 1 0 0 0 0 0 1 1 1 1 0 1 1 3 9 37 42 9 1 0 0 1 1 2 13 18 4 1 0 0 1 0 0 1 2 0 0 0 1 2 4 13 43 47 12 2 0 1 1 2 3 15 22 7 2 0 0 1 0 0 1 3 2 1 0 1 2 3 7 24 31 14 3 0 1 1 2 2 9 16 10 3 0 0 1 1 1 1 3 3 1 0 1 1 2 4 13 20 13 4 0 1 1 1 2 6 11 9 3 0 1 1 0 0 1 2 3 2 0 1 1 1 3 7 11 7 2 0 0 0 1 1 4 6 5 2 0 0 0 0 1 1 1 2 2 0 0 0 0 1 2 2 1 0 0 0 0 0 1 1 2 1 0 0 0 0 0 0 0 0 0 0 I/Sigma = 71.55 Thresh = 0.020 Blend = F #Contributing = 41 InitialProfileWt = 0.009 Region 8 Sum = 31835.2; Maximum = 1164.52; FM = 0.821 !Region 8: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 1 1 0 0 0 0 0 1 2 2 1 1 1 0 0 0 1 0 0 0 0 0 0 0 1 2 2 1 1 1 0 0 0 1 3 6 5 2 1 1 0 0 0 1 0 0 0 0 0 0 0 1 5 6 2 1 1 1 0 0 2 12 21 12 3 1 1 0 0 1 1 0 0 0 0 0 0 0 2 9 10 4 1 1 0 0 0 3 23 38 18 3 1 1 0 0 0 1 0 0 0 0 0 0 0 2 6 8 2 1 1 0 0 0 3 17 28 11 2 1 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 1 1 0 0 0 0 1 4 5 3 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 1 1 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 8: Section 4->6 0 0 0 0 1 0 0 0 0 0 0 0 0 1 1 1 0 0 0 0 0 0 1 2 1 0 0 0 0 1 2 3 3 1 1 0 0 0 1 2 8 9 3 1 0 0 0 1 1 9 13 5 1 0 0 1 3 9 14 8 2 1 0 0 1 1 8 36 35 9 1 0 0 0 1 6 42 52 15 2 0 0 1 11 32 39 16 3 1 0 0 1 4 30 92 67 14 2 0 0 0 2 18100 96 24 3 0 0 2 21 56 49 14 2 1 0 0 1 8 46 96 52 9 1 0 0 1 3 24 94 72 18 3 0 0 2 16 38 25 6 1 0 0 0 1 6 27 41 22 5 1 0 0 0 2 12 37 31 10 2 0 0 1 3 7 6 2 1 0 0 0 1 2 5 11 9 3 1 0 0 0 1 3 11 13 5 1 0 0 0 1 1 1 1 0 0 0 0 0 1 1 3 2 1 0 0 0 0 0 1 3 3 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 1 0 0 0 !Region 8: Section 7->9 0 0 0 0 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 4 7 4 1 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 2 17 27 11 2 0 0 0 0 0 1 4 4 2 0 0 0 0 0 0 0 1 1 0 0 0 1 5 37 48 18 3 0 0 0 0 1 2 7 7 3 1 0 0 0 0 0 1 1 1 0 0 0 1 6 33 35 16 5 1 0 0 0 1 2 6 9 6 1 0 0 0 0 0 1 3 3 1 0 0 1 3 12 16 11 5 1 0 0 1 1 1 4 8 7 2 0 0 0 0 0 1 3 3 1 0 0 0 1 4 7 5 2 0 0 0 0 0 1 2 4 4 1 0 0 0 0 0 1 2 2 0 0 0 0 1 1 2 2 1 0 0 0 0 0 1 1 1 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 I/Sigma = 244.19 Thresh = 0.020 Blend = F #Contributing = 135 InitialProfileWt = 0.000 Region 9 Sum = 250990; Maximum = 19105.7; FM = 0.818 !Region 9: Section 1->3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 2 2 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 0 0 1 10 14 2 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 4 4 1 0 0 0 0 0 1 14 29 6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 2 1 0 0 0 0 0 1 5 11 3 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 9: Section 4->6 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 1 2 0 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 6 8 1 0 0 0 0 0 1 8 14 2 0 0 0 0 0 0 6 11 3 0 0 0 0 0 1 23 44 7 0 0 0 0 0 1 33 63 12 1 0 0 0 0 1 25 46 13 1 0 0 0 0 2 32 77 18 0 0 0 0 0 1 43100 26 1 0 0 0 0 1 30 71 26 3 0 0 0 0 1 11 30 8 0 0 0 0 0 1 13 38 13 1 0 0 0 0 0 8 26 14 2 0 0 0 0 0 1 3 1 0 0 0 0 0 0 1 3 2 0 0 0 0 0 0 1 2 2 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 !Region 9: Section 7->9 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 2 4 2 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 9 18 9 1 0 0 0 0 0 1 4 4 1 0 0 0 0 0 0 1 1 0 0 0 0 0 0 9 28 19 4 0 0 0 0 0 1 6 9 3 0 0 0 0 0 0 1 2 1 0 0 0 0 0 2 10 12 3 0 0 0 0 0 0 3 6 2 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 1 2 1 0 0 0 0 0 0 0 1 1 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 0 Overall Integration Statistics for this run ("*" => excluded from output) Spots with topped/rescanned pixels: 9 Total topped/rescanned pixels: 127 Minimum pixel ceiling(frame): 163809(neal054_06_0001.sfrm) Maximum pixel ceiling(frame): 163809(neal054_06_0001.sfrm) Total spots predicted: 848 Spots with absolute HKL > 511: 0* Spots outside resolution limit: 0* Spots outside active detector area: 92* Outside frame limits: 40* Spots exceeding frame queue size: 0* Collisions(same XY, adjacent frame): 0* Spots exceeding dynamic range: 6* Spots with too many spot components: 0* Spots with large Lorentz factor: 0* Spots with too much missing I: 0* Spots with too few BG pixels: 0* Spots below I/sigma threshold: 0* Spots left in Write-Behind Cache: 0* Spots with unwanted components: 0* Total unwanted components: 0* Good spots written: 708 Total spot components written: 708 Twin overlaps integrated: 0 Partial, strong, full overlaps: 0 0 0 Full overlaps collapsed to singlet: 0 Singlets (used in stats below): 708 Twin overlaps written: 0 Average Intensity: 58734.07 Average I/sigma: 86.1 % over "strong" threshold: 91.67 % less than 2 sigma: 1.13 % which spanned more than 1 frame: 89.55 Average X,Y,Z positional errors: 0.11 -0.03 -0.05 RMS X,Y,Z positional errors: 0.60 0.35 0.13 % X,Y,Z more than 0.5 pixel: 9.75 4.38 0.71 % X,Y,Z more than 1.0 pixel: 4.66 1.98 0.14 Avg % profile volume populated: 97.91 Avg % profile volume integrated: 14.70 Avg % profile missing I: 1.96 Avg % profile missing volume: 2.09 Avg % volume overlap in H,K,L: 0.00 0.00 0.00 Percent of profile used in X,Y,Z: 88.89 100.00 100.00 Max % intensity on XYZ boundaries: 3.13 5.36 3.29 Average spot-shape correlation: 0.758 RMS spot-shape correlation: 0.775 Profile Shape Correlation I/sigma from to Correl +/- # 0.0 1.0 0.303 0.225 4 1.0 2.0 0.384 0.190 4 2.0 4.0 0.544 0.141 9 4.0 8.0 0.715 0.147 24 8.0 16.0 0.734 0.139 52 16.0 32.0 0.759 0.143 145 32.0 64.0 0.760 0.147 229 64.0 128.0 0.811 0.139 150 128.0 256.0 0.854 0.105 91 Write-behind Cache Diagnostics Entered in Write-Behind Cache: 0 Removed from WBC: 0 Partial overlaps from WBC: 0 Exceeding queue size from WBC: 0 With > 12 components from WBC: 0 Elapsed since program start (sec): 99.255 Elapsed since INTEGRATE command (sec): 97.779 Integration time, this run (sec): 4.466 Time in unit-cell LS (sec): 0.025 Per-frame integration time (sec): 0.055 Integration completed normally ======================== 10/26/2021 10:23:32 Applying profile correlation filter from /smb/isengard/data/neal054/work/unsorted.raw to /smb/isengard/data/neal054/work/corrfilt.raw Scale of 1.1293873 will be applied to LS-fit intensities Number of spots read: 708 Number of LS-fit intensities scaled: 46 Number rejected due to poor spot shape: 0 Number unwritable (I, sigma too large): 0 Number written: 708 Sorting Reflection File ============================== 10/26/2021 10:23:32 Integration of neal054 Sorting input files: 1 /smb/isengard/data/neal054/work/corrfilt.raw Sorting to output file /smb/isengard/data/neal054/work/neal054_06.raw Component 1 in sample 1 (1 in file): Point group "2/m(B-unique)", #3 (internal number) 4 symmetry operators 1 0 0 -1 0 0 -1 0 0 1 0 0 0 1 0 0 1 0 0-1 0 0-1 0 0 0 1 0 0-1 0 0-1 0 0 1 Beginning sort with 128MB memory requested... 708 spot components in 708 spots read from file 1--/smb/isengard/data/neal054/work/corrfilt.raw 708 spot components in 708 spots written to file /smb/isengard/data/neal054/work/neal054_06.raw Computing Reflection File Statistics ========== 10/26/2021 10:23:32 Integration of neal054 ................................................................................... Statistics for reflections in neal054_06.raw File is in BrukerAXS area detector ASCII format File contains a single sample component Number of lines read (incl comments) = 708 Number of reflection records read = 708 Number of records with bad component number = 0 Number of records with bad status value = 0 Number of spots used = 708 Number of spot components used = 708 ................................................................................... Integration of neal054 Statistics for sample 1 of 1 in neal054_06.raw Lattice: P (Primitive) Point group "2/m(B-unique)", #3 (internal number) 4 symmetry operators 1 0 0 -1 0 0 -1 0 0 1 0 0 0 1 0 0 1 0 0-1 0 0-1 0 0 0 1 0 0-1 0 0-1 0 0 1 Component numbers S.C(F) below: S=sample, C=component in sample, F=component in file Cell constants are constrained so that consistent sin(theta) is computed for symmetry equivalents. Components in the sample map (* marks current component) Component Wanted A B C Alpha Beta Gamma PointGp Constraints 1.1(1)* Y 6.247 11.748 13.009 90.000 96.757 90.000 2/mB Monoclinic B-uniq Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Det X # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 17 0 17 0 0.0 10990.338 25.47 10.76 0.000 0.000 0.0 0.000 0.000 0.00 2.3-.34-.17 3.1 1.3 .31 32.000 16 0 16 0 0.0 11934.169 27.96 10.82 0.000 0.000 0.0 0.000 0.000 0.00 .47 .03-.09 1.4 .47 .16 64.000 36 0 36 0 2.8 16231.711 32.99 10.94 0.000 0.000 0.0 0.000 0.000 0.00 .03-.11-.07 .68 .45 .29 96.000 45 0 45 0 0.0 19608.271 35.50 11.05 0.000 0.000 0.0 0.000 0.000 0.00 .22-.01-.05 .53 .31 .12 128.000 62 0 62 0 1.6 19747.041 34.66 11.43 0.000 0.000 0.0 0.000 0.000 0.00 .04-.10-.05 .50 .55 .14 160.000 88 0 87 2 2.3 26595.642 42.21 11.77 0.041 0.000 0.2 0.000 0.000 0.00 .09-.05-.06 .21 .18 .10 192.000 101 0 99 4 1.0 37956.294 52.35 12.34 0.012 0.000 0.7 0.000 0.000 0.00 .12-.06-.05 .16 .16 .09 224.000 111 0 111 0 0.0 54965.714 70.71 12.97 0.000 0.000 0.0 0.000 0.000 0.00 .13-.01-.03 .16 .37 .12 256.000 102 3 99 6 2.0 80365.227 102.82 13.64 0.067 0.000 6.3 0.000 0.131 0.00-.07-.00-.04 .09 .14 .10 288.000 66 6 61 11 1.5 129817.54 153.02 14.93 0.105 0.001 17.7 0.000 0.205 0.00-.04-.00-.04 .07 .15 .08 320.000 38 6 35 9 0.0 143802.68 197.06 14.38 0.113 0.010 24.7 0.000 0.257 0.00-.06 .03-.03 .10 .08 .09 352.000 15 4 14 5 0.0 137068.73 241.50 14.43 0.157 -0.039 33.9 0.000 0.315 0.00-.03 .06 .01 .10 .13 .11 384.000 7 1 7 1 0.0 265430.96 416.64 14.13 0.064 0.008 23.3 0.000 0.129 0.00-.13 .09-.03 .18 .13 .09 416.000 3 0 3 0 0.0 31559.000 173.97 13.22 0.000 0.000 0.0 0.000 0.000 0.00-.17 .08-.07 .18 .11 .07 448.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 480.000 1 0 1 0 0.0 7516.200 90.67 11.75 0.000 0.000 0.0 0.000 0.000 0.00-1.1 .40 .22 1.1 .40 .22 512.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Det Y # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 20 0 20 2 0.0 39043.880 61.56 11.07 0.012 -0.000 0.7 0.000 0.000 0.00 .19 .31-.14 .55 .93 .23 32.000 42 0 42 1 2.4 51929.905 81.01 11.44 0.039 0.000 0.2 0.000 0.000 0.00 .14 .02-.07 .49 .35 .11 64.000 61 0 61 1 1.6 59009.332 96.39 11.91 0.043 -0.000 0.2 0.000 0.000 0.00 .06 .01-.07 .49 .26 .13 96.000 88 0 88 2 0.0 62021.411 85.42 12.73 0.012 0.000 0.7 0.000 0.000 0.00 .02-.06-.03 .36 .14 .12 128.000 106 0 106 0 1.9 66965.084 89.10 13.45 0.000 0.000 0.0 0.000 0.000 0.00 .14-.03-.04 .62 .13 .11 160.000 107 6 105 8 1.9 64097.105 86.86 13.81 0.157 0.000 29.2 0.000 0.272 0.00 .06-.02-.05 .66 .08 .11 192.000 112 10 110 12 1.8 57139.494 83.88 13.16 0.072 0.011 14.2 0.000 0.159 0.00 .04 .00-.03 .29 .09 .09 224.000 65 8 64 9 0.0 70106.783 98.72 12.63 0.102 -0.002 17.4 0.000 0.218 0.00 .13-.01-.04 .55 .18 .21 256.000 54 2 54 2 0.0 53046.717 87.42 11.59 0.132 -0.019 31.2 0.000 0.263 0.00 .17-.05-.03 .72 .39 .15 288.000 40 1 40 1 0.0 34616.517 66.06 11.26 0.278 -0.007 23.9 0.000 0.556 0.00 .25-.15-.05 .55 .43 .11 320.000 13 0 13 0 0.0 31395.315 48.57 11.16 0.000 0.000 0.0 0.000 0.000 0.00 .98-.92-.11 2.0 1.7 .20 352.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 384.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 416.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 448.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 480.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 512.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Det R # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 25 2 25 2 0.0 55459.868 74.85 12.25 0.037 -0.004 3.5 0.000 0.073 0.00 .07 .04-.01 .13 .09 .04 30.000 76 6 75 7 0.0 64318.861 88.38 13.04 0.078 0.012 9.2 0.000 0.171 0.00 .03 .02-.01 .13 .11 .08 60.000 107 6 104 9 1.9 72884.655 97.25 13.69 0.080 0.000 15.9 0.000 0.192 0.00 .06-.01-.05 .16 .11 .09 90.000 127 6 124 9 2.4 68899.092 91.96 13.53 0.165 -0.003 33.2 0.000 0.327 0.00 .05-.05-.04 .14 .17 .08 120.000 108 3 106 6 0.9 68456.219 94.80 12.93 0.098 -0.003 22.4 0.000 0.214 0.00 .07-.09-.03 .38 .42 .13 150.000 98 0 98 1 0.0 47350.358 75.32 12.25 0.014 0.000 0.9 0.000 0.000 0.00 .03-.05-.05 .37 .21 .19 180.000 69 0 69 1 0.0 45816.228 74.07 11.62 0.043 -0.000 0.2 0.000 0.000 0.00 .06-.08-.08 .41 .28 .12 210.000 59 0 59 2 1.7 47618.011 84.41 11.26 0.015 -0.000 0.6 0.000 0.000 0.00 .14-.06-.06 .64 .25 .13 240.000 28 0 28 1 3.6 20210.909 40.03 10.89 0.010 0.001 0.5 0.000 0.000 0.00 1.0-.07-.13 2.4 1.2 .28 270.000 11 0 11 0 0.0 17826.864 37.84 10.84 0.000 0.000 0.0 0.000 0.000 0.00 .00 .59-.13 1.6 .75 .20 300.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Quadrnt # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 1.000 78 0 78 0 0.0 24268.540 43.73 11.22 0.000 0.000 0.0 0.000 0.000 0.00 .43-.30-.07 1.1 .81 .16 2.000 29 3 29 3 0.0 95323.324 146.66 11.93 0.142 -0.023 28.8 0.000 0.284 0.00-.06 .10 .02 .11 .17 .07 3.000 398 0 395 6 1.3 33796.641 51.00 12.07 0.013 0.000 0.6 0.000 0.000 0.00 .16-.01-.05 .63 .28 .14 4.000 203 16 190 29 1.5 115672.79 148.43 14.50 0.106 0.003 19.3 0.000 0.215 0.00-.06-.00-.04 .12 .13 .10 5.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Region # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 1.000 223 11 214 20 0.9 68391.091 91.90 13.25 0.090 0.008 14.1 0.000 0.211 0.00 .05 .00-.03 .15 .13 .08 2.000 12 3 11 4 0.0 176398.88 298.15 13.58 0.131 -0.013 35.2 0.000 0.286 0.00-.07 .03 .03 .10 .08 .05 3.000 2 0 2 0 0.0 74161.900 164.00 11.54 0.000 0.000 0.0 0.000 0.000 0.00 .12 .29 .14 .18 .33 .18 4.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.000 11 0 11 0 0.0 24962.946 40.42 11.10 0.000 0.000 0.0 0.000 0.000 0.00 .59-.69-.12 .99 1.3 .20 6.000 73 0 73 0 0.0 15282.866 30.97 11.03 0.000 0.000 0.0 0.000 0.000 0.00 .47-.22-.09 1.4 .67 .25 7.000 169 0 169 2 1.2 25211.830 40.87 11.59 0.011 -0.000 0.4 0.000 0.000 0.00 .15 .02-.05 .70 .26 .12 8.000 172 0 171 4 1.7 68656.392 89.68 12.98 0.013 0.000 0.6 0.000 0.000 0.00 .04-.03-.05 .13 .32 .13 9.000 46 5 43 8 2.2 143776.06 210.82 15.43 0.147 -0.013 28.1 0.000 0.329 0.00-.08 .00-.04 .19 .17 .09 10.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Frame# # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 2.230 41 0 41 1 0.0 57258.482 90.24 12.69 0.014 -0.000 0.9 0.000 0.000 0.00 .14-.04-.02 .63 .69 .12 6.057 31 0 31 2 0.0 44584.453 72.60 12.29 0.011 -0.000 0.4 0.000 0.000 0.00 .14 .03 .01 .60 .13 .12 9.885 38 1 38 3 2.6 45362.724 72.45 12.47 0.052 -0.008 7.4 0.000 0.148 0.00 .06-.03-.02 .33 .17 .09 13.712 38 0 38 0 0.0 62709.674 89.46 12.67 0.000 0.000 0.0 0.000 0.000 0.00 .01-.03-.00 .32 .18 .07 17.540 31 1 31 2 3.2 58642.072 84.85 12.54 0.101 0.012 12.2 0.000 0.202 0.00 .07-.08-.02 .41 .21 .11 21.367 36 0 36 0 0.0 68455.111 96.31 12.48 0.000 0.000 0.0 0.000 0.000 0.00 .10 .07-.07 .54 .63 .30 25.195 30 1 30 1 0.0 54062.206 80.73 13.02 0.152 0.008 24.4 0.000 0.304 0.00-.09-.04-.01 .53 .07 .09 29.022 36 1 36 1 0.0 66548.725 93.85 12.89 0.179 0.018 41.8 0.000 0.358 0.00 .05-.03-.00 .44 .11 .10 32.850 31 0 31 0 3.2 60283.336 89.65 12.62 0.000 0.000 0.0 0.000 0.000 0.00 .31-.09-.03 1.2 .27 .10 36.677 39 3 39 3 0.0 59620.857 86.92 12.92 0.079 0.019 16.2 0.000 0.158 0.00 .15-.02-.05 .56 .36 .09 40.505 34 0 34 0 0.0 40982.247 62.44 12.36 0.000 0.000 0.0 0.000 0.000 0.00 .29-.26-.07 1.2 .79 .14 44.332 34 2 34 2 2.9 64611.257 92.06 13.01 0.076 0.015 11.3 0.000 0.152 0.00 .10-.08-.09 .21 .22 .12 48.160 33 2 33 2 0.0 93019.091 121.01 12.71 0.102 0.011 16.4 0.000 0.205 0.00 .10 .02-.10 .47 .14 .13 51.987 42 1 42 1 2.4 38745.019 61.78 12.47 0.055 -0.011 11.4 0.000 0.109 0.00 .02 .05-.05 .38 .20 .09 55.815 33 2 33 2 0.0 53966.227 79.85 12.67 0.190 -0.039 27.7 0.000 0.380 0.00 .06 .06-.09 .39 .20 .13 59.642 37 2 37 2 0.0 44563.613 71.64 12.80 0.110 -0.004 8.7 0.000 0.220 0.00 .11 .06-.10 .73 .25 .14 63.470 34 2 34 2 0.0 65902.568 88.79 12.73 0.198 -0.029 46.5 0.000 0.397 0.00 .10 .00-.06 .21 .08 .09 67.297 32 1 32 1 0.0 62623.481 88.28 12.44 0.081 -0.011 20.0 0.000 0.162 0.00 .21-.07-.07 .50 .33 .13 71.125 40 7 40 7 5.0 60912.785 85.78 12.76 0.081 -0.022 16.4 0.000 0.162 0.00 .16-.16-.07 .75 .38 .17 74.952 38 6 38 6 2.6 75305.302 99.32 12.77 0.127 0.021 20.0 0.000 0.253 0.00 .19-.05-.04 .59 .20 .12 78.780 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Rot.Ang # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 10.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 20.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 30.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 40.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 50.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 60.000 95 1 93 6 1.1 51905.548 81.41 12.56 0.042 -0.003 4.0 0.000 0.148 0.00 .14-.01-.01 .56 .46 .11 70.000 88 1 88 2 1.1 55056.901 82.05 12.50 0.101 0.005 12.2 0.000 0.202 0.00 .03-.01-.02 .35 .44 .12 80.000 94 2 94 2 0.0 67246.532 94.60 12.82 0.172 0.009 33.1 0.000 0.344 0.00 .02-.03-.03 .52 .12 .18 90.000 88 3 88 3 1.1 57560.645 84.65 12.75 0.079 0.009 16.2 0.000 0.158 0.00 .20-.07-.04 .80 .33 .10 100.000 90 4 90 4 1.1 66687.156 94.94 12.71 0.088 0.011 13.8 0.000 0.175 0.00 .16-.09-.09 .78 .49 .13 110.000 97 5 97 5 1.0 42981.732 67.02 12.61 0.125 -0.023 16.8 0.000 0.251 0.00 .08 .06-.08 .55 .22 .12 120.000 94 4 94 4 2.1 59867.080 86.09 12.65 0.120 -0.016 28.3 0.000 0.241 0.00 .11-.05-.06 .39 .23 .12 130.000 62 12 62 12 1.6 74658.716 98.50 12.79 0.110 0.002 19.5 0.000 0.219 0.00 .20-.10-.06 .73 .33 .15 140.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 150.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 160.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 170.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 180.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 190.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 200.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 210.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 220.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 230.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 240.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 250.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 260.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 270.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 280.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 290.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 300.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 310.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 320.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 330.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 340.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 350.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 360.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Hours # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 4.460 72 0 72 3 0.0 51801.608 82.79 12.52 0.013 -0.000 0.6 0.000 0.000 0.00 .14-.01-.00 .61 .52 .12 4.510 101 2 101 5 1.0 57297.096 83.94 12.61 0.072 0.001 9.4 0.000 0.176 0.00 .05-.04-.01 .35 .19 .08 4.560 55 0 55 0 1.8 62325.149 92.33 12.53 0.000 0.000 0.0 0.000 0.000 0.00 .01 .03-.04 .59 .51 .26 4.610 91 2 91 2 1.1 58802.255 86.01 12.81 0.172 0.010 33.1 0.000 0.344 0.00 .13-.05-.02 .73 .19 .10 4.660 76 4 76 4 1.3 53298.040 79.99 12.70 0.088 0.019 17.7 0.000 0.177 0.00 .22-.13-.07 .90 .59 .12 4.710 65 3 65 3 0.0 75849.443 102.62 12.82 0.075 0.007 11.0 0.000 0.150 0.00 .08-.02-.08 .36 .19 .11 4.760 100 5 100 5 1.0 43647.040 68.89 12.57 0.125 -0.022 16.8 0.000 0.251 0.00 .07 .05-.08 .55 .23 .12 4.810 60 3 60 3 0.0 64680.288 88.37 12.67 0.144 -0.023 37.7 0.000 0.289 0.00 .12-.04-.07 .28 .18 .11 4.860 88 13 88 13 3.4 68954.158 93.68 12.77 0.103 0.001 18.0 0.000 0.207 0.00 .19-.09-.06 .68 .32 .15 4.910 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 4.960 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.010 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.060 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.110 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.160 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.210 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.260 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.310 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.360 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.410 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.460 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Batch# # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 7.000 708 16 689 38 1.1 58742.886 85.92 12.67 0.106 0.000 17.1 0.000 0.225 0.00 .11-.03-.05 .60 .35 .13 8.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Correl # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 2 0 2 0100.0 200.342 1.33 11.53 0.000 0.000 0.0 0.000 0.000 0.00 .43-.08-.16 .45 .23 .21 0.100 2 0 2 0100.0 96.555 0.60 12.44 0.000 0.000 0.0 0.000 0.000 0.00 .03-.12-.03 .66 .21 .28 0.200 2 0 2 0 50.0 261.393 1.81 13.62 0.000 0.000 0.0 0.000 0.000 0.00 2.0-.18-.06 2.9 .25 .13 0.300 3 0 3 0 0.0 30608.299 57.43 11.80 0.000 0.000 0.0 0.000 0.000 0.00 1.7-.07 .04 2.6 .34 .18 0.400 39 0 39 1 2.6 33845.779 50.86 12.21 0.043 -0.000 0.2 0.000 0.000 0.00 .15-.02-.05 .65 .13 .08 0.500 81 0 81 1 2.5 38175.505 56.76 12.53 0.014 0.000 0.9 0.000 0.000 0.00 .17-.03-.07 .52 .16 .12 0.600 104 2 104 2 0.0 48604.827 72.34 12.40 0.034 0.001 3.2 0.000 0.068 0.00 .08-.02-.06 .59 .20 .11 0.700 123 7 120 11 0.0 60893.942 87.01 12.85 0.119 -0.003 22.0 0.000 0.230 0.00 .09 .00-.04 .51 .31 .10 0.800 215 8 213 11 0.0 56321.798 80.60 12.55 0.080 -0.002 14.5 0.000 0.164 0.00 .14-.09-.05 .61 .39 .16 0.900 137 9 135 12 0.0 90735.596 130.97 13.13 0.116 0.003 20.1 0.000 0.224 0.00 .02 .01-.03 .46 .49 .14 1.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Missing # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 694 16 676 37 1.2 59565.405 86.82 12.70 0.106 -0.000 17.6 0.000 0.225 0.00 .08-.02-.04 .44 .21 .12 0.050 1 0 1 0 0.0 14945.700 29.44 10.85 0.000 0.000 0.0 0.000 0.000 0.00 .06 .10 .01 .06 .10 .01 0.100 3 0 3 0 0.0 12893.367 35.09 11.14 0.000 0.000 0.0 0.000 0.000 0.00 1.0-.31-.11 1.9 .79 .29 0.150 2 0 2 0 0.0 12435.487 28.59 10.79 0.000 0.000 0.0 0.000 0.000 0.00 2.3-.01-.16 3.0 .35 .17 0.200 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.250 2 0 2 1 0.0 31903.501 42.74 10.94 0.010 0.008 0.5 0.000 0.000 0.00 2.2-.32-.16 2.9 .81 .16 0.300 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.350 1 0 1 0 0.0 37046.500 42.64 11.27 0.000 0.000 0.0 0.000 0.000 0.00 .36-.94-.14 .36 .94 .14 0.400 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.450 3 0 3 0 0.0 21920.067 29.32 10.89 0.000 0.000 0.0 0.000 0.000 0.00 3.6-1.7-.50 4.6 2.7 .56 0.500 1 0 1 0 0.0 4671.200 9.11 11.08 0.000 0.000 0.0 0.000 0.000 0.00 2.9-4.0-.58 2.9 4.0 .58 0.550 1 0 1 0 0.0 1790.000 5.70 11.07 0.000 0.000 0.0 0.000 0.000 0.00 .59 3.7-.77 .59 3.7 .77 0.600 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.650 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.700 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.750 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.800 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.850 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.900 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.950 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 1.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Frac Z # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 51 3 51 3 3.9 56022.147 91.25 12.79 0.080 0.010 14.7 0.000 0.161 0.00 .19-.08-.08 .67 .28 .26 0.050 34 2 34 2 2.9 52654.633 83.52 12.30 0.103 -0.000 20.3 0.000 0.206 0.00 .10 .06-.06 .56 .33 .11 0.100 24 2 24 2 0.0 57608.596 79.75 12.50 0.107 0.023 17.9 0.000 0.214 0.00 .11-.12-.05 .44 .31 .10 0.150 38 0 38 0 0.0 46849.429 67.64 12.61 0.000 0.000 0.0 0.000 0.000 0.00 .32-.12-.03 .90 .66 .13 0.200 39 2 39 2 0.0 65599.782 95.25 12.81 0.055 0.004 9.4 0.000 0.110 0.00 .38-.11-.06 1.3 .92 .17 0.250 28 5 28 5 0.0 65644.576 94.58 13.17 0.096 -0.046 16.8 0.000 0.192 0.00 .05 .02-.03 .18 .09 .09 0.300 45 2 45 2 2.2 62155.982 79.92 13.28 0.093 -0.003 17.4 0.000 0.186 0.00-.01-.04-.01 .23 .18 .07 0.350 30 2 30 2 0.0 68934.964 92.12 13.18 0.090 0.015 14.6 0.000 0.181 0.00 .05-.07-.03 .35 .16 .08 0.400 25 1 25 1 0.0 57013.839 82.43 12.44 0.279 -0.030 58.8 0.000 0.557 0.00 .05-.06 .00 .16 .23 .10 0.450 44 3 44 3 2.3 57579.593 87.01 12.58 0.120 0.029 22.2 0.000 0.241 0.00-.06-.02-.02 .52 .13 .10 0.500 35 0 35 0 2.9 53885.289 80.92 12.25 0.000 0.000 0.0 0.000 0.000 0.00 .06-.04-.03 .30 .19 .09 0.550 32 1 32 3 0.0 65343.206 93.99 12.96 0.056 0.010 6.3 0.000 0.140 0.00 .06-.05-.02 .23 .11 .09 0.600 41 2 41 2 0.0 70946.063 96.16 12.78 0.132 -0.019 31.2 0.000 0.263 0.00-.00-.02-.04 .10 .12 .09 0.650 37 3 37 3 0.0 72039.022 99.28 12.92 0.048 0.001 10.7 0.000 0.096 0.00 .26-.08-.09 .92 .39 .19 0.700 42 2 42 2 0.0 87176.279 113.68 12.90 0.082 -0.002 12.9 0.000 0.164 0.00 .10-.02-.07 .57 .15 .11 0.750 31 0 31 0 0.0 58706.919 85.40 12.46 0.000 0.000 0.0 0.000 0.000 0.00 .18 .04-.09 .59 .23 .13 0.800 32 1 32 1 0.0 47969.110 75.56 12.38 0.166 0.047 43.6 0.000 0.333 0.00 .11-.01-.07 .60 .18 .10 0.850 26 0 26 2 0.0 35919.806 61.57 12.38 0.011 0.001 0.4 0.000 0.000 0.00 .25 .16-.06 .77 .46 .15 0.900 38 1 38 1 0.0 42788.211 67.21 12.27 0.250 -0.044 53.4 0.000 0.499 0.00 .08-.02-.06 .46 .30 .13 0.950 36 0 36 2 5.6 39776.075 66.08 12.07 0.014 0.001 0.5 0.000 0.000 0.00 .00-.04-.05 .34 .20 .13 1.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) PeakCts # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 2038.906 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 4077.812 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 8155.625 37 0 37 0 8.1 9012.811 24.26 13.69 0.000 0.000 0.0 0.000 0.000 0.00 .05-.04 .00 .15 .09 .15 16311.250 250 2 249 5 1.2 31560.625 48.92 12.79 0.064 -0.001 4.7 0.000 0.234 0.00 .06-.03-.04 .20 .11 .10 32622.500 258 5 256 9 0.8 50171.241 71.62 12.19 0.043 0.002 4.1 0.000 0.104 0.00 .05-.04-.05 .36 .19 .14 65245.000 119 5 117 8 0.0 83179.882 114.66 12.55 0.120 -0.001 18.5 0.000 0.234 0.00 .38 .00-.07 1.1 .58 .16 130490.000 36 8 30 14 0.0 228264.83 226.15 14.35 0.118 0.001 27.4 0.000 0.231 0.00 .23-.19-.05 1.2 .96 .14 260980.000 6 2 6 2 0.0 182093.45 319.19 13.52 0.091 -0.006 28.8 0.000 0.182 0.00-.29 .11 .04 .47 .19 .11 521960.000 2 0 2 0 0.0 606826.00 550.16 12.78 0.000 0.000 0.0 0.000 0.000 0.00-.20 .17-.07 .25 .20 .15 1043920.0 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) BgndCts # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 1.766 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 3.532 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.298 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 7.064 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 8.830 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 10.596 380 1 378 6 1.1 29086.806 50.06 11.45 0.056 -0.001 4.4 0.000 0.556 0.00 .19-.05-.06 .81 .47 .16 12.362 211 7 207 12 0.5 70697.140 90.95 13.16 0.104 -0.004 15.2 0.000 0.263 0.00 .06-.01-.03 .14 .09 .10 14.128 68 6 66 8 1.5 130048.95 147.37 14.96 0.093 0.009 18.9 0.000 0.192 0.00-.03-.01-.04 .08 .05 .09 15.894 49 7 44 12 4.1 138296.97 172.66 16.81 0.118 -0.002 24.2 0.000 0.215 0.00-.04-.03-.03 .07 .15 .07 17.660 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) ErrX # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ -1.500 2 0 2 0 0.0 966.883 4.80 10.82 0.000 0.000 0.0 0.000 0.000 0.00-2.2 .04 .27 2.3 .04 .28 -1.380 1 0 1 0 0.0 2113.400 7.16 11.71 0.000 0.000 0.0 0.000 0.000 0.00-1.3 .07 .25 1.3 .07 .25 -1.260 1 0 1 0 0.0 12182.700 28.50 10.75 0.000 0.000 0.0 0.000 0.000 0.00-1.2-.33 .02 1.2 .33 .02 -1.140 3 0 3 0 0.0 4890.297 22.82 11.23 0.000 0.000 0.0 0.000 0.000 0.00-1.1 .36 .04 1.1 .42 .15 -1.020 2 0 2 0 50.0 5677.459 18.98 10.92 0.000 0.000 0.0 0.000 0.000 0.00-.94-.13 .12 .94 .36 .13 -0.900 3 0 3 0 0.0 2972.967 10.10 11.38 0.000 0.000 0.0 0.000 0.000 0.00-.85-.06 .19 .85 .49 .19 -0.780 4 0 4 0 0.0 9838.125 24.11 11.16 0.000 0.000 0.0 0.000 0.000 0.00-.75 .09 .19 .75 .31 .20 -0.660 4 0 4 0 25.0 8159.160 22.67 11.29 0.000 0.000 0.0 0.000 0.000 0.00-.59-.02 .14 .59 .05 .15 -0.540 3 0 3 0 0.0 12092.367 29.76 10.93 0.000 0.000 0.0 0.000 0.000 0.00-.51 .06 .06 .51 .30 .11 -0.420 10 0 10 0 0.0 84075.980 141.89 11.36 0.000 0.000 0.0 0.000 0.000 0.00-.36 .02-.05 .36 .22 .13 -0.300 20 2 20 3 0.0 27060.635 64.70 11.98 0.091 0.011 15.8 0.000 0.182 0.00-.23-.01-.00 .23 .37 .10 -0.180 118 8 118 8 0.8 82549.925 113.82 13.11 0.122 -0.015 22.9 0.000 0.243 0.00-.10-.01-.01 .11 .12 .09 -0.060 219 16 213 23 0.0 84563.673 114.56 13.54 0.106 0.007 18.2 0.000 0.205 0.00-.01-.01-.03 .04 .09 .09 0.060 179 0 179 3 1.1 47015.990 60.85 12.45 0.013 0.000 0.5 0.000 0.000 0.00 .12-.04-.05 .13 .10 .09 0.180 67 0 67 1 0.0 37480.466 56.04 12.23 0.010 0.000 0.5 0.000 0.000 0.00 .22-.03-.08 .22 .15 .11 0.300 20 0 20 0 5.0 13431.123 29.52 11.36 0.000 0.000 0.0 0.000 0.000 0.00 .36-.18-.13 .37 .38 .16 0.420 7 0 7 0 14.3 15398.344 32.37 11.17 0.000 0.000 0.0 0.000 0.000 0.00 .49-.13-.15 .49 .29 .17 0.540 10 0 10 0 0.0 15411.200 30.78 11.00 0.000 0.000 0.0 0.000 0.000 0.00 .60 .31-.33 .60 1.2 .55 0.660 5 0 5 0 20.0 8070.994 20.97 11.59 0.000 0.000 0.0 0.000 0.000 0.00 .69-.05-.19 .69 .32 .22 0.780 3 0 3 0 0.0 17855.133 33.96 10.84 0.000 0.000 0.0 0.000 0.000 0.00 .85-.25-.17 .85 .39 .17 0.900 2 0 2 0 0.0 7138.750 18.84 11.07 0.000 0.000 0.0 0.000 0.000 0.00 .97-.06-.09 .98 .30 .17 1.020 1 0 1 0 0.0 2816.700 9.51 11.01 0.000 0.000 0.0 0.000 0.000 0.00 1.1 .43 .11 1.1 .43 .11 1.140 1 0 1 0 0.0 3808.100 11.66 11.15 0.000 0.000 0.0 0.000 0.000 0.00 1.2 .22-.30 1.2 .22 .30 1.260 4 0 4 0 0.0 20300.050 37.24 10.86 0.000 0.000 0.0 0.000 0.000 0.00 1.3-.55-.18 1.3 .94 .20 1.380 19 0 19 0 0.0 7084.999 18.27 10.78 0.000 0.000 0.0 0.000 0.000 0.00 2.9-.50-.25 3.2 1.6 .33 1.500 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) ErrY # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ -1.500 4 0 4 0 0.0 10537.325 17.88 10.89 0.000 0.000 0.0 0.000 0.000 0.00 3.9-2.9-.50 4.3 3.1 .55 -1.380 1 0 1 0 0.0 26625.801 37.33 10.92 0.000 0.000 0.0 0.000 0.000 0.00 1.3-1.3-.11 1.3 1.3 .11 -1.260 1 0 1 0 0.0 1811.000 7.14 11.09 0.000 0.000 0.0 0.000 0.000 0.00 1.3-1.2-.32 1.3 1.2 .32 -1.140 1 0 1 0 0.0 14031.900 25.28 10.82 0.000 0.000 0.0 0.000 0.000 0.00 4.2-1.1-.19 4.2 1.1 .19 -1.020 3 0 3 0 0.0 17797.533 34.72 13.21 0.000 0.000 0.0 0.000 0.000 0.00 .54-.99-.09 .90 .99 .12 -0.900 1 0 1 0 0.0 1249.100 5.93 10.72 0.000 0.000 0.0 0.000 0.000 0.00 1.9-.89-.08 1.9 .89 .08 -0.780 2 0 2 0 0.0 7060.650 21.81 10.95 0.000 0.000 0.0 0.000 0.000 0.00 .72-.68-.02 1.1 .68 .24 -0.660 4 0 4 0 0.0 13975.950 29.13 11.12 0.000 0.000 0.0 0.000 0.000 0.00 .24-.58-.07 .67 .58 .18 -0.540 10 0 10 1 10.0 8524.961 25.25 11.30 0.039 0.000 0.2 0.000 0.000 0.00 .08-.47-.01 .44 .47 .15 -0.420 14 0 14 0 7.1 11362.434 27.97 11.04 0.000 0.000 0.0 0.000 0.000 0.00 .72-.35-.22 1.5 .35 .44 -0.300 37 0 37 1 2.7 23627.307 43.34 11.38 0.014 -0.001 0.9 0.000 0.000 0.00 .14-.23-.07 .41 .24 .14 -0.180 154 4 154 4 1.3 55796.915 74.80 12.65 0.183 0.002 33.3 0.000 0.366 0.00 .04-.10-.04 .16 .11 .10 -0.060 330 15 324 23 0.6 73110.174 97.39 13.26 0.100 -0.002 18.8 0.000 0.226 0.00 .02-.01-.03 .28 .04 .09 0.060 91 7 91 7 1.1 62037.971 97.15 12.50 0.084 0.005 11.8 0.000 0.168 0.00 .03 .10-.04 .33 .11 .09 0.180 28 0 28 0 0.0 57605.566 103.00 11.66 0.000 0.000 0.0 0.000 0.000 0.00 .06 .22-.07 .45 .22 .14 0.300 11 0 11 2 0.0 13308.851 31.70 11.05 0.011 0.003 0.4 0.000 0.000 0.00 .74 .34-.03 1.7 .35 .14 0.420 7 0 7 0 0.0 5878.572 20.25 11.03 0.000 0.000 0.0 0.000 0.000 0.00 .42 .47 .07 1.1 .47 .18 0.540 3 0 3 0 0.0 15401.367 33.62 10.79 0.000 0.000 0.0 0.000 0.000 0.00-.22 .58 .01 1.1 .58 .13 0.660 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.780 1 0 1 0 0.0 5341.700 16.63 10.66 0.000 0.000 0.0 0.000 0.000 0.00 1.8 .88-.10 1.8 .88 .10 0.900 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 1.020 1 0 1 0 0.0 32984.301 44.45 11.08 0.000 0.000 0.0 0.000 0.000 0.00-.18 1.1-.35 .18 1.1 .35 1.140 1 0 1 0 0.0 4187.000 12.61 10.64 0.000 0.000 0.0 0.000 0.000 0.00 2.1 1.2-.38 2.1 1.2 .38 1.260 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 1.380 3 0 3 0 0.0 2795.367 9.92 10.88 0.000 0.000 0.0 0.000 0.000 0.00 1.9 2.3-.47 2.2 2.5 .51 1.500 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) ErrZ # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ -1.500 1 0 1 0 0.0 2543.300 8.36 11.01 0.000 0.000 0.0 0.000 0.000 0.00 .66-.30-1.5 .66 .30 1.5 -1.380 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 -1.260 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 -1.140 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 -1.020 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 -0.900 1 0 1 0 0.0 26070.000 30.07 10.72 0.000 0.000 0.0 0.000 0.000 0.00 4.4-2.2-.85 4.4 2.2 .85 -0.780 1 0 1 0 0.0 1790.000 5.70 11.07 0.000 0.000 0.0 0.000 0.000 0.00 .59 3.7-.77 .59 3.7 .77 -0.660 1 0 1 0 0.0 4671.200 9.11 11.08 0.000 0.000 0.0 0.000 0.000 0.00 2.9-4.0-.58 2.9 4.0 .58 -0.540 2 0 2 0 50.0 2309.972 10.90 12.82 0.000 0.000 0.0 0.000 0.000 0.00 1.5-.11-.43 2.0 .13 .43 -0.420 14 0 14 0 7.1 7023.219 19.35 11.33 0.000 0.000 0.0 0.000 0.000 0.00 1.3-.06-.33 2.2 1.4 .33 -0.300 26 0 26 0 3.8 59752.291 110.26 11.61 0.000 0.000 0.0 0.000 0.000 0.00 .68-.14-.22 1.2 .46 .22 -0.180 241 9 239 13 0.4 61813.732 83.95 12.63 0.109 0.001 16.9 0.000 0.196 0.00 .18-.04-.11 .47 .22 .11 -0.060 356 11 351 17 0.6 63824.661 89.13 12.90 0.094 0.004 15.2 0.000 0.201 0.00 .01-.02-.01 .20 .12 .03 0.060 47 6 47 7 2.1 47067.141 85.83 12.63 0.123 -0.044 24.6 0.000 0.258 0.00-.14 .02 .09 .37 .17 .09 0.180 15 0 15 1 6.7 2564.829 11.86 11.41 0.039 0.001 0.2 0.000 0.000 0.00-.26-.02 .22 1.4 .39 .22 0.300 1 0 1 0 0.0 423.465 2.47 10.79 0.000 0.000 0.0 0.000 0.000 0.00-2.9 .05 .34 2.9 .05 .34 0.420 1 0 1 0 0.0 5895.300 20.04 13.70 0.000 0.000 0.0 0.000 0.000 0.00-.09-.12 .42 .09 .12 .42 0.540 1 0 1 0 0.0 22748.500 38.16 12.81 0.000 0.000 0.0 0.000 0.000 0.00 .03-.10 .55 .03 .10 .55 0.660 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.780 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.900 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 1.020 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 1.140 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 1.260 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 1.380 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 1.500 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) #Equivs # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 670 0 670 0 1.2 53286.697 79.33 12.56 0.000 0.000 0.0 0.000 0.000 0.00 .12-.04-.05 .62 .36 .13 1.000 38 16 19 38 0.0 154944.10 173.04 14.49 0.106 0.000 17.1 0.000 0.225 0.00-.05 .01-.01 .09 .14 .08 2.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 3.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 4.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 6.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 7.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 8.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 9.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 10.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Compon# # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 1.000 708 16 689 38 1.1 58742.886 85.92 12.67 0.106 0.000 17.1 0.000 0.225 0.00 .11-.03-.05 .60 .35 .13 2.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 3.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 4.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 5.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 6.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 7.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 8.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 9.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Angstms # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 9999.000 113 12 101 24 1.8 138473.85 193.55 15.05 0.117 0.000 25.1 0.000 0.241 0.00-.06 .01-.02 .14 .13 .09 1.893 98 4 94 8 1.0 92128.906 112.98 13.80 0.055 0.000 5.7 0.000 0.110 0.00-.06 .00-.04 .08 .10 .10 1.504 97 0 97 0 0.0 61268.007 77.69 12.79 0.000 0.000 0.0 0.000 0.000 0.00 .08-.02-.04 .14 .15 .08 1.314 78 0 78 0 1.3 42706.017 59.63 12.56 0.000 0.000 0.0 0.000 0.000 0.00 .12 .00-.04 .17 .44 .14 1.194 68 0 66 4 0.0 39164.132 51.58 12.11 0.012 0.000 0.7 0.000 0.000 0.00 .11-.06-.05 .14 .17 .08 1.108 71 0 70 2 2.8 25118.485 41.16 11.73 0.041 0.000 0.2 0.000 0.000 0.00 .10-.05-.06 .23 .20 .11 1.043 56 0 56 0 1.8 19901.535 34.91 11.48 0.000 0.000 0.0 0.000 0.000 0.00 .07-.12-.05 .52 .58 .14 0.991 50 0 50 0 0.0 18754.474 33.98 11.13 0.000 0.000 0.0 0.000 0.000 0.00 .16-.06-.06 .52 .39 .12 0.948 46 0 46 0 2.2 16674.428 33.40 10.96 0.000 0.000 0.0 0.000 0.000 0.00 .06-.04-.06 .63 .32 .26 0.911 31 0 31 0 0.0 12061.698 27.67 10.79 0.000 0.000 0.0 0.000 0.000 0.00 1.5-.16-.13 2.5 .98 .25 0.880 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Intens # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 28 0 27 2 28.6 568.372 3.44 12.25 0.041 0.000 0.2 0.000 0.000 0.00 .08-.12-.04 1.1 .31 .19 1302.662 25 0 25 0 0.0 1934.880 7.79 11.70 0.000 0.000 0.0 0.000 0.000 0.00 .31 .12-.10 1.2 .87 .39 2605.324 45 0 45 0 0.0 3959.291 13.26 11.88 0.000 0.000 0.0 0.000 0.000 0.00 .39-.03-.06 .93 .73 .18 5210.648 60 0 60 0 0.0 7660.362 21.23 12.40 0.000 0.000 0.0 0.000 0.000 0.00 .25-.10-.04 1.1 .60 .12 10421.297 131 0 131 0 0.0 14859.299 30.42 11.97 0.000 0.000 0.0 0.000 0.000 0.00 .13-.04-.05 .56 .21 .10 20842.594 125 1 125 1 0.0 30987.435 46.14 12.09 0.278 -0.002 23.9 0.000 0.556 0.00 .12-.05-.05 .47 .29 .13 41685.188 140 4 135 11 0.0 59393.434 70.13 12.81 0.096 0.001 9.9 0.000 0.292 0.00 .05-.02-.05 .12 .11 .08 83370.375 95 6 92 9 0.0 113664.54 109.21 13.75 0.085 -0.008 13.5 0.000 0.229 0.00 .02-.02-.04 .11 .08 .08 166740.750 50 9 46 13 0.0 242058.94 203.22 14.82 0.111 -0.000 26.2 0.000 0.245 0.00-.06 .01-.04 .08 .06 .08 333481.500 9 2 9 2 0.0 427970.00 291.29 15.07 0.113 0.023 27.3 0.000 0.225 0.00-.07 .01-.06 .13 .12 .10 666963.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) #Sigmas # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 8 0 8 0100.0 159.259 1.13 13.45 0.000 0.000 0.0 0.000 0.000 0.00 .01-.14-.09 .54 .24 .24 1.901 8 0 8 0 0.0 403.770 2.74 11.92 0.000 0.000 0.0 0.000 0.000 0.00 .09-.13-.04 1.8 .28 .18 3.614 16 0 15 2 0.0 1156.955 5.27 11.65 0.041 0.000 0.2 0.000 0.000 0.00-.05 .16-.02 .71 .97 .26 6.870 46 0 46 0 0.0 2940.294 9.94 11.61 0.000 0.000 0.0 0.000 0.000 0.00 .52-.15-.09 1.5 .94 .29 13.060 77 0 77 0 0.0 7451.390 19.71 12.06 0.000 0.000 0.0 0.000 0.000 0.00 .29-.01-.04 .78 .33 .13 24.828 200 0 200 0 0.0 19471.206 35.30 11.96 0.000 0.000 0.0 0.000 0.000 0.00 .13-.07-.05 .57 .28 .12 47.198 190 3 187 8 0.0 54810.330 64.65 12.65 0.067 -0.002 6.1 0.000 0.308 0.00 .08-.02-.05 .17 .12 .08 89.725 104 6 100 10 0.0 109108.38 115.12 13.90 0.059 0.002 9.5 0.000 0.143 0.00-.03-.00-.04 .14 .09 .08 170.569 54 9 46 17 0.0 243187.00 215.65 14.93 0.122 -0.001 28.4 0.000 0.248 0.00-.05 .01-.03 .07 .07 .08 324.255 5 1 5 1 0.0 414072.80 444.67 14.04 0.064 0.007 23.3 0.000 0.129 0.00-.14 .09-.02 .19 .14 .10 616.417 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Rsym # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 8 2 4 8 0.0 82797.763 90.31 13.25 0.010 0.000 0.9 0.000 0.018 0.00 .03 .04-.04 .10 .18 .09 0.030 7 3 4 7 0.0 140955.26 158.96 13.70 0.048 0.004 5.0 0.000 0.094 0.00-.06 .01 .01 .11 .24 .10 0.060 7 4 4 7 0.0 207237.93 233.20 15.54 0.072 -0.002 16.8 0.000 0.148 0.00-.07-.01 .01 .09 .04 .07 0.090 2 2 2 2 0.0 262549.00 222.69 14.19 0.104 0.104 23.4 0.000 0.208 0.00-.03 .07 .02 .04 .07 .04 0.120 4 4 4 4 0.0 176841.25 192.90 14.29 0.134 -0.021 25.8 0.000 0.267 0.00-.09-.03-.03 .11 .04 .08 0.150 5 5 5 5 0.0 173147.02 193.05 15.84 0.169 0.148 27.8 0.000 0.338 0.00-.03 .03-.04 .03 .06 .06 0.180 1 1 1 1 0.0 155163.00 176.32 16.29 0.197 -0.197 34.7 0.000 0.393 0.00-.03-.07 .10 .03 .07 .10 0.210 1 1 1 1 0.0 57910.000 141.83 16.34 0.219 -0.219 31.0 0.000 0.438 0.00-.11-.08 .14 .11 .08 .14 0.240 1 1 1 1 0.0 289731.00 214.14 17.33 0.250 -0.250 53.4 0.000 0.499 0.00-.04 .05-.12 .04 .05 .12 0.270 2 2 2 2 0.0 93569.550 168.17 12.61 0.279 -0.279 41.3 0.000 0.557 0.00-.15-.08 .01 .16 .11 .06 0.300 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.330 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.360 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.390 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.420 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.450 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.480 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.510 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.540 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.570 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.600 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) dI/I # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ -0.500 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 -0.460 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 -0.420 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 -0.380 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 -0.340 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 -0.300 2 2 2 2 0.0 93569.550 168.17 12.61 0.279 -0.279 41.3 0.000 0.557 0.00-.15-.08 .01 .16 .11 .06 -0.260 1 1 1 1 0.0 289731.00 214.14 17.33 0.250 -0.250 53.4 0.000 0.499 0.00-.04 .05-.12 .04 .05 .12 -0.220 2 2 2 2 0.0 106536.50 165.39 16.31 0.203 -0.203 32.9 0.000 0.405 0.00-.07-.07 .12 .08 .08 .12 -0.180 1 1 1 1 0.0 56752.102 78.66 15.79 0.165 -0.165 13.0 0.000 0.330 0.00-.04 .07-.11 .04 .07 .11 -0.140 2 2 2 2 0.0 207845.50 230.17 12.58 0.132 -0.132 31.2 0.000 0.263 0.00-.15-.04-.02 .15 .04 .07 -0.100 4 4 4 4 0.0 175366.62 207.19 15.23 0.077 -0.077 15.5 0.000 0.155 0.00-.06-.00 .03 .07 .05 .07 -0.060 4 3 4 4 0.0 134715.07 152.95 13.51 0.044 -0.044 4.5 0.000 0.088 0.00-.03 .09 .01 .08 .16 .06 -0.020 7 2 4 7 0.0 80689.129 87.82 13.29 0.008 0.003 0.7 0.000 0.018 0.00 .05 .05-.04 .10 .19 .10 0.020 4 3 4 4 0.0 136346.20 152.04 13.71 0.046 0.046 4.8 0.000 0.093 0.00-.10-.08 .01 .13 .27 .11 0.060 3 3 3 3 0.0 249733.00 264.27 15.95 0.068 0.068 18.5 0.000 0.135 0.00-.08-.01-.02 .12 .03 .07 0.100 3 3 3 3 0.0 200185.33 189.45 14.51 0.107 0.107 19.4 0.000 0.213 0.00-.04 .03 .02 .04 .06 .03 0.140 5 5 5 5 0.0 205039.80 213.05 16.05 0.164 0.164 31.0 0.000 0.327 0.00-.03 .02-.04 .03 .05 .06 0.180 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.220 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.260 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.300 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.340 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.380 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.420 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.460 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 0.500 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) dI/sig # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 8 1 4 8 0.0 58134.956 79.98 12.68 0.006 0.000 0.4 0.000 0.001 0.00 .03 .00-.01 .13 .27 .11 1.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 2.000 2 1 1 2 0.0 99516.602 106.49 13.43 0.020 0.000 2.1 0.000 0.040 0.00-.07 .07-.06 .07 .11 .09 3.000 1 1 1 1 0.0 116697.00 121.56 14.07 0.031 0.031 3.7 0.000 0.061 0.00-.04 .11 .02 .04 .11 .02 4.000 3 2 2 3 0.0 74654.867 92.73 13.18 0.048 -0.016 4.5 0.000 0.088 0.00-.07 .03 .03 .08 .08 .06 5.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 6.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 7.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 8.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 9.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 10.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 11.000 3 2 2 3 0.0 257789.67 191.95 16.08 0.059 0.012 11.3 0.000 0.124 0.00-.04-.00-.02 .04 .05 .07 12.000 1 1 1 1 0.0 56752.102 78.66 15.79 0.165 -0.165 13.0 0.000 0.330 0.00-.04 .07-.11 .04 .07 .11 13.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 14.000 1 1 1 1 0.0 192468.00 217.97 17.08 0.068 0.068 14.8 0.000 0.135 0.00-.02 .00-.02 .02 .00 .02 15.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 16.000 2 2 2 2 0.0 108542.55 160.47 14.88 0.102 -0.018 16.3 0.000 0.204 0.00-.04 .01 .02 .04 .07 .04 17.000 1 1 1 1 0.0 325330.00 247.96 15.62 0.070 0.070 17.3 0.000 0.140 0.00-.02 .02-.10 .02 .02 .10 18.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 19.000 1 1 1 1 0.0 279904.00 246.39 14.50 0.081 -0.081 20.0 0.000 0.162 0.00-.08 .01 .10 .08 .01 .10 20.000 1 1 1 1 0.0 201556.00 281.90 17.10 0.074 -0.074 20.9 0.000 0.148 0.00-.03 .06-.06 .03 .06 .06 21.000 0 0 0 0 0.0 0.000 0.00 0.00 0.000 0.000 0.0 0.000 0.000 0.00 .00 .00 .00 .00 .00 .00 22.000 1 1 1 1 0.0 307938.00 211.79 14.07 0.106 0.106 22.5 0.000 0.213 0.00-.03 .08-.01 .03 .08 .01 23.000 2 2 2 2 0.0 131987.05 258.85 13.55 0.091 0.022 23.6 0.000 0.182 0.00-.21-.10 .01 .21 .12 .06 24.000 11 6 6 11 0.0 205884.08 218.95 15.41 0.174 -0.014 36.7 0.000 0.350 0.00-.06-.01 .00 .08 .05 .09 25.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Overall # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 708 16 689 38 1.1 58742.886 85.92 12.67 0.106 0.000 17.1 0.000 0.225 0.00 .11-.03-.05 .60 .35 .13 1.000 Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) Centric # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 36 0 36 0 5.6 77729.736 140.28 14.10 0.000 0.000 0.0 0.000 0.000 0.00 .01 .04-.01 .12 .11 .07 1.000 Coverage Statistics Integration of neal054 ...1.1(1): component 1 in sample 1 (component 1 in neal054_06.raw) .......Shell...... Angstrms #Obs Theory %Compl Redund Rsym Pairs %Pairs Rshell #Sigma %<2s to 1.893 101 164 61.59 1.12 0.117 12 7.32 0.117 193.55 1.8 to 1.504 195 323 60.37 1.08 0.109 16 4.95 0.055 112.98 1.0 to 1.314 292 478 61.09 1.05 0.109 16 3.35 0.000 77.69 0.0 to 1.194 370 631 58.64 1.04 0.109 16 2.54 0.000 59.63 1.3 to 1.108 436 788 55.33 1.04 0.106 16 2.03 0.012 51.58 0.0 to 1.043 506 934 54.18 1.04 0.106 16 1.71 0.041 41.16 2.8 to 0.991 562 1093 51.42 1.03 0.106 16 1.46 0.000 34.91 1.8 to 0.948 612 1248 49.04 1.03 0.106 16 1.28 0.000 33.98 0.0 to 0.911 658 1393 47.24 1.03 0.106 16 1.15 0.000 33.40 2.2 to 0.880 689 1548 44.51 1.03 0.106 16 1.03 0.000 27.67 0.0