SAINT V7.16B SAINT C:\SAXI\SAINT32\Int.slm /BATCH /NOPROMPT /SCALES:1020 Time decay correction ====================================== 11/02/05 13:53:21 Computing time decay correction from C:\frames\jsib001\work\jsib001m.raw Total reflections read from input file: 17531 Uninterpretable reflections (excluded): 0 Number of multi-component refls (excluded): 0 Number below I/sigma threshold (excluded): 15171 Remaining number considered for time decay: 2360 TIME DECAY RESULTS: Decay rate vs (ST/L)**2 Decay StdDev Slope StdDev #Points Correl Status 0.0000 0.0000 0.0000 0.0000 0 0.0000 0 Applying decay correction from C:\frames\jsib001\work\jsib001m.raw to C:\frames\jsib001\work\jsib001t.raw Number of reflections read from input file = 17531 Number of reflections corrected and written = 17531 Average, min, max correction factor: 1.000 1.000 1.000 Computing Reflection File Statistics ========== 11/02/05 13:53:22 jsib001 Point group sequence #, name: 10, "mmm" Number of symmetry operators: 8 1 0 0 -1 0 0 -1 0 0 1 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 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 0 0-1 0 0-1 0 0 1 0 0 1 Orientation read from C:\frames\jsib001\jsib0011.p4p: Cell constants computed from input file: 9.997 12.469 16.416 90.000 90.000 90.000 ............................. Statistics for reflections in C:\frames\jsib001\work\jsib001t.raw File is in BrukerAXS area detector ASCII format File contains a single sample component Number of spots read from file = 17531 Det X # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 61 2 46 60 9.8 1249.046 55.86 2.48 0.028 0.017 1.2 0.032 0.032 0.49 .09-.01-.04 .25 .20 .26 32.000 230 14 124 230 4.8 1281.406 44.29 2.44 0.033 0.016 1.2 0.033 0.018 0.52 .03-.01-.04 .15 .13 .18 64.000 352 25 169 352 8.2 1218.312 36.25 2.41 0.034 0.002 0.9 0.031 0.027 0.63 .01 .02-.04 .22 .16 .14 96.000 508 45 209 508 8.3 625.890 21.03 2.30 0.039 0.006 0.7 0.037 0.019 0.46 .02 .00-.04 .20 .19 .14 128.000 706 66 268 706 8.8 491.218 15.76 2.21 0.043 0.002 0.6 0.041 0.035 0.65 .03 .02-.04 .21 .20 .13 160.000 874 92 339 874 7.7 404.758 12.43 2.16 0.050 0.003 0.6 0.047 0.026 0.47 .02 .03-.04 .22 .22 .13 192.000 1063 116 389 1063 10.3 363.022 10.73 2.12 0.056 -0.002 0.6 0.054 0.036 0.57 .04 .05-.04 .23 .26 .13 224.000 1227 152 433 1227 18.2 260.987 7.99 2.10 0.076 0.000 0.6 0.072 0.056 0.61 .03 .04-.03 .28 .30 .13 256.000 1386 171 472 1386 22.3 181.770 5.76 2.12 0.090 -0.023 0.5 0.084 0.074 0.69-.30 .05-.02 .44 .31 .13 288.000 1557 211 508 1556 28.6 149.599 4.68 2.11 0.096 -0.005 0.4 0.091 0.073 0.65-.25 .03-.02 .45 .31 .14 320.000 1623 237 541 1621 34.5 112.422 3.60 2.10 0.122 -0.004 0.4 0.112 0.107 0.79-.19 .05-.02 .43 .35 .16 352.000 1710 263 575 1709 53.2 76.589 2.62 2.08 0.155 -0.002 0.4 0.140 0.141 0.83-.16 .03-.02 .48 .38 .18 384.000 1716 280 570 1708 75.4 43.163 1.66 2.06 0.236 -0.016 0.4 0.215 0.203 0.78-.08 .03-.01 .53 .40 .21 416.000 1800 303 593 1793 85.6 29.895 1.20 2.03 0.312 -0.009 0.4 0.284 0.274 0.74-.03 .01-.01 .62 .43 .23 448.000 1770 309 604 1746 89.3 28.698 1.07 2.01 0.358 0.002 0.4 0.329 0.337 0.81-.01 .02-.01 .68 .44 .22 480.000 948 167 405 866 88.8 30.104 1.05 2.00 0.359 -0.008 0.4 0.336 0.396 0.88 .03 .01-.00 .72 .44 .22 512.000 Det Y # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 537 62 482 518 51.0 103.339 3.97 2.00 0.117 0.054 0.5 0.108 0.201 0.79-.04-.03-.01 .39 .39 .15 32.000 983 131 776 959 50.3 142.616 5.29 2.02 0.096 0.032 0.5 0.083 0.154 0.95-.03-.04-.01 .42 .40 .15 64.000 1036 164 814 1025 50.3 137.843 5.05 2.03 0.100 0.027 0.5 0.090 0.120 0.81-.03-.04-.01 .44 .38 .15 96.000 1141 190 861 1135 45.9 171.662 6.09 2.05 0.079 0.014 0.5 0.073 0.076 0.65-.06-.01-.00 .46 .36 .16 128.000 1194 222 899 1191 44.1 182.221 6.20 2.06 0.075 0.007 0.4 0.071 0.066 0.61-.04 .01-.02 .48 .33 .18 160.000 1242 247 915 1241 40.3 221.589 7.40 2.09 0.074 0.007 0.5 0.070 0.066 0.69-.08 .02-.02 .50 .34 .19 192.000 1282 264 904 1276 41.8 266.894 8.75 2.11 0.068 0.001 0.5 0.061 0.058 0.64-.10 .05-.03 .50 .31 .18 224.000 1319 275 772 1317 40.8 280.799 8.89 2.12 0.066 -0.024 0.5 0.061 0.047 0.65-.06 .08-.02 .50 .31 .18 256.000 1312 229 923 1311 43.1 289.682 8.86 2.18 0.063 -0.026 0.5 0.057 0.049 0.69-.08-.00-.03 .53 .32 .18 288.000 1300 180 940 1300 43.5 263.671 8.30 2.18 0.064 -0.015 0.5 0.061 0.062 0.61-.10 .02-.03 .53 .29 .19 320.000 1244 142 917 1243 45.7 227.293 7.34 2.16 0.070 -0.011 0.5 0.067 0.113 0.80-.12 .03-.03 .51 .32 .19 352.000 1215 105 893 1214 48.1 180.076 6.08 2.14 0.082 -0.009 0.5 0.076 0.152 0.78-.08 .05-.03 .48 .35 .20 384.000 1154 88 839 1150 47.9 177.185 5.89 2.12 0.078 0.006 0.4 0.075 0.117 0.67-.12 .07-.03 .47 .38 .18 416.000 1041 69 787 1033 48.6 165.097 5.73 2.10 0.091 0.014 0.5 0.084 0.257 0.75-.11 .06-.02 .44 .39 .17 448.000 987 55 746 969 50.1 133.035 4.74 2.08 0.102 0.036 0.5 0.091 0.341 0.97-.12 .07-.03 .44 .39 .16 480.000 544 30 471 523 52.2 106.981 4.00 2.06 0.116 0.046 0.5 0.108 0.341 0.89-.09 .12-.03 .42 .42 .16 512.000 Det R # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 276 54 137 276 17.4 255.952 7.56 2.15 0.079 -0.044 0.6 0.073 0.064 0.69-.15 .08-.03 .38 .31 .12 30.000 797 150 357 796 19.1 299.606 8.55 2.14 0.069 -0.032 0.6 0.064 0.048 0.56-.15 .05-.03 .39 .28 .13 60.000 1284 222 553 1283 21.0 253.051 7.58 2.15 0.070 -0.019 0.5 0.065 0.050 0.61-.14 .05-.03 .39 .27 .14 90.000 1783 267 749 1781 21.9 260.546 7.80 2.15 0.067 -0.012 0.5 0.063 0.052 0.66-.13 .04-.03 .39 .28 .15 120.000 2178 303 912 2177 29.2 218.331 6.82 2.14 0.074 -0.008 0.5 0.069 0.065 0.68-.11 .03-.03 .42 .30 .17 150.000 2437 330 1071 2436 42.5 233.195 7.83 2.12 0.068 -0.002 0.5 0.065 0.058 0.68-.09 .02-.02 .46 .32 .18 180.000 2672 351 1210 2671 53.6 216.751 7.81 2.10 0.069 0.011 0.5 0.064 0.065 0.72-.07 .03-.02 .52 .37 .20 210.000 2951 361 1336 2945 59.5 160.731 5.93 2.07 0.085 0.024 0.5 0.080 0.124 0.76-.05 .01-.01 .53 .37 .19 240.000 1877 244 995 1863 69.6 122.319 4.65 2.04 0.108 0.030 0.5 0.098 0.324 0.85-.03 .03-.02 .53 .40 .19 270.000 1276 171 654 1177 78.9 81.590 3.05 2.00 0.139 0.026 0.5 0.113 0.427 0.88 .00 .01-.01 .57 .47 .19 300.000 Quadrnt # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 1.000 2531 136 680 2530 10.7 509.185 15.65 2.24 0.046 0.004 0.6 0.044 0.028 0.53-.00 .03-.04 .22 .24 .14 2.000 6266 762 2146 6213 61.4 80.031 2.74 2.10 0.151 -0.030 0.4 0.138 0.154 0.78-.14 .05-.02 .56 .39 .20 3.000 2490 376 723 2490 11.2 496.244 15.62 2.15 0.047 0.003 0.6 0.045 0.033 0.58 .06 .02-.03 .25 .24 .13 4.000 6244 1179 2134 6172 58.2 80.722 2.88 2.03 0.149 0.010 0.4 0.135 0.133 0.75-.11 .01-.01 .54 .38 .19 5.000 Region# # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 1.000 2546 449 717 2544 20.0 270.155 7.94 2.15 0.070 -0.026 0.5 0.065 0.050 0.61-.14 .05-.03 .39 .28 .14 2.000 2625 488 1024 2617 74.7 46.648 1.69 2.05 0.238 -0.020 0.4 0.214 0.208 0.81-.05 .02-.02 .67 .36 .24 3.000 3341 403 1523 3288 71.1 57.112 2.02 2.07 0.196 -0.028 0.4 0.177 0.219 0.81-.11 .05-.02 .55 .42 .20 4.000 1619 46 747 1619 23.4 193.710 6.22 2.12 0.085 0.016 0.5 0.082 0.069 0.64-.16 .10-.03 .36 .33 .14 5.000 1011 16 345 1011 7.4 499.703 16.89 2.25 0.043 0.014 0.7 0.042 0.038 0.53-.02 .02-.05 .19 .18 .15 6.000 555 91 120 554 8.8 1388.380 35.87 2.54 0.033 -0.004 0.9 0.031 0.023 0.56 .05 .01-.03 .22 .17 .13 7.000 997 114 356 997 6.9 475.523 16.32 2.14 0.044 0.009 0.7 0.042 0.029 0.52 .05 .01-.03 .22 .20 .13 8.000 1580 229 731 1580 23.8 178.232 5.96 2.06 0.086 0.021 0.5 0.080 0.077 0.73-.08-.03-.02 .35 .31 .13 9.000 3257 617 1615 3195 68.7 56.416 2.09 2.01 0.192 0.032 0.4 0.173 0.165 0.77-.06-.01-.01 .54 .42 .19 10.000 Frame# # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 1.190 871 130 629 863 48.9 181.125 6.07 2.12 0.086 -0.027 0.5 0.080 0.162 0.86-.09-.05 .01 .50 .35 .17 16.322 870 250 716 870 51.1 193.131 6.62 2.11 0.080 0.007 0.5 0.076 0.103 0.78-.08 .06-.01 .49 .34 .17 31.453 919 254 738 917 46.4 193.820 6.48 2.09 0.076 -0.004 0.5 0.076 0.066 0.71-.04 .10-.04 .43 .35 .17 46.584 887 239 722 880 46.6 203.557 6.95 2.09 0.070 -0.004 0.5 0.065 0.085 0.71-.05 .15-.03 .47 .39 .18 61.716 879 232 720 875 47.8 196.040 6.61 2.09 0.079 -0.008 0.5 0.071 0.079 0.73-.02 .10-.03 .47 .36 .18 76.848 894 223 734 892 45.9 205.105 6.96 2.10 0.072 -0.005 0.5 0.065 0.062 0.65-.03 .07-.03 .46 .35 .17 91.979 883 204 732 878 46.3 212.082 7.11 2.10 0.073 -0.012 0.5 0.065 0.064 0.60-.05 .11-.03 .48 .38 .18 107.111 887 184 737 872 43.2 218.231 7.26 2.12 0.072 -0.014 0.5 0.065 0.056 0.50-.01 .10-.04 .47 .38 .18 122.242 892 163 714 882 46.0 191.778 6.47 2.10 0.078 0.000 0.5 0.075 0.069 0.63-.08 .08-.03 .50 .35 .18 137.374 905 112 682 894 44.1 203.552 6.93 2.10 0.077 -0.007 0.5 0.070 0.072 0.71-.06 .05-.04 .50 .34 .19 152.505 864 81 627 861 43.1 206.807 6.96 2.10 0.076 -0.011 0.5 0.069 0.063 0.75-.09 .04-.05 .51 .35 .19 167.637 894 64 726 890 42.2 206.780 6.90 2.10 0.079 -0.006 0.5 0.071 0.091 1.04-.11 .01-.03 .47 .33 .18 182.768 887 59 740 881 44.0 220.712 7.29 2.11 0.071 0.015 0.5 0.067 0.339 1.05-.13-.05-.02 .48 .35 .17 197.900 879 27 739 876 44.4 196.460 6.53 2.10 0.076 0.008 0.5 0.069 0.381 1.23-.09-.03-.02 .47 .33 .17 213.031 890 20 733 887 47.3 230.888 7.70 2.10 0.075 0.021 0.5 0.069 0.406 0.72-.12-.07-.02 .47 .33 .16 228.163 882 4 705 875 43.2 211.564 7.00 2.10 0.076 0.014 0.5 0.068 0.056 0.45-.11-.09-.01 .46 .34 .16 243.294 899 1 704 890 46.6 187.225 6.45 2.10 0.077 0.011 0.5 0.075 0.371 0.00-.13-.08-.01 .52 .34 .18 258.426 898 14 727 886 45.4 203.138 6.88 2.10 0.076 0.014 0.5 0.072 0.021 0.67-.12-.01-.00 .46 .33 .17 273.557 898 80 761 894 47.1 182.240 6.33 2.09 0.081 0.005 0.5 0.078 0.035 0.59-.09 .01-.00 .48 .34 .18 288.689 653 112 576 642 47.6 176.349 6.13 2.09 0.078 -0.003 0.5 0.074 0.053 0.67-.11 .05-.02 .46 .34 .18 303.820 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 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 70.000 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 80.000 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 90.000 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 .00 100.000 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 .00 110.000 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 .00 120.000 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 .00 130.000 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 .00 140.000 99 22 95 97 48.5 204.539 6.93 2.05 0.074 0.002 0.5 0.069 0.162 1.38-.10 .05-.02 .48 .29 .17 150.000 892 346 584 881 49.4 158.479 5.67 2.07 0.086 -0.001 0.5 0.082 0.087 0.76-.09 .03 .01 .50 .34 .17 160.000 988 344 620 984 46.3 176.714 6.23 2.08 0.080 0.016 0.5 0.079 0.057 0.66-.08-.00 .01 .47 .33 .17 170.000 978 272 600 969 44.4 218.622 7.48 2.09 0.073 0.015 0.5 0.074 0.073 0.75-.10-.02 .01 .47 .31 .17 180.000 990 269 588 982 45.5 183.645 6.28 2.07 0.079 0.016 0.5 0.072 0.080 0.72-.14-.04 .00 .50 .34 .16 190.000 966 247 587 963 42.8 217.246 7.29 2.08 0.077 0.022 0.5 0.071 0.064 0.63-.13-.03-.00 .46 .32 .16 200.000 984 249 628 983 46.4 210.091 7.11 2.09 0.074 0.018 0.5 0.067 0.068 0.61-.13-.00-.01 .47 .33 .17 210.000 973 248 637 970 42.7 209.026 6.88 2.10 0.074 0.024 0.5 0.068 0.065 0.56-.12-.02-.03 .47 .34 .17 220.000 971 223 641 967 40.8 209.610 6.83 2.10 0.076 0.004 0.5 0.071 0.090 0.77-.12 .03-.02 .50 .33 .18 230.000 965 142 643 962 42.6 213.913 7.15 2.10 0.076 -0.007 0.5 0.069 0.067 0.71-.10 .04-.04 .49 .34 .19 240.000 997 45 572 986 44.5 199.530 6.84 2.11 0.079 -0.012 0.5 0.074 0.067 0.79-.05 .05-.04 .51 .34 .19 250.000 977 19 624 963 45.9 208.430 7.09 2.11 0.073 -0.005 0.5 0.066 0.062 0.72-.07 .06-.03 .47 .37 .19 260.000 975 7 667 957 46.7 198.121 6.69 2.12 0.074 -0.024 0.5 0.068 0.571 0.95-.03 .07-.04 .47 .38 .19 270.000 990 15 640 986 47.6 222.899 7.42 2.12 0.072 -0.017 0.5 0.064 0.521 0.96-.00 .04-.04 .49 .37 .18 280.000 990 1 661 983 48.4 202.994 6.85 2.11 0.073 -0.007 0.5 0.067 0.098 0.48-.02 .05-.03 .47 .37 .18 290.000 969 0 672 961 45.9 194.047 6.48 2.11 0.077 -0.012 0.5 0.000 0.000 0.00-.03 .08-.04 .47 .39 .18 300.000 974 0 657 967 46.0 204.047 6.77 2.11 0.072 -0.006 0.5 0.000 0.000 0.00-.05 .12-.05 .46 .38 .17 310.000 991 1 648 989 49.3 193.028 6.39 2.12 0.081 -0.009 0.5 0.075 1.874 0.00-.09 .06-.04 .46 .35 .19 320.000 797 3 620 792 48.9 197.991 6.52 2.14 0.083 -0.014 0.5 0.075 0.499 0.97-.09-.02 .00 .49 .35 .18 330.000 65 0 65 63 64.6 229.331 7.92 2.18 0.068 -0.048 0.5 0.000 0.000 0.00-.12-.16 .02 .50 .44 .19 340.000 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 Hours # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 852 3 803 850 50.7 194.616 6.31 2.15 0.085 -0.008 0.5 0.078 0.499 0.97-.07 .07-.01 .48 .39 .17 0.126 909 0 842 908 47.7 207.556 7.02 2.08 0.077 -0.011 0.5 0.000 0.000 0.00-.03 .20-.04 .47 .42 .18 0.252 846 0 681 842 46.0 221.051 7.49 2.09 0.075 -0.015 0.5 0.000 0.000 0.00-.04 .13-.07 .48 .38 .20 0.378 908 0 585 905 41.9 197.033 6.78 2.06 0.085 -0.008 0.5 0.000 0.000 0.00-.11 .06-.08 .51 .33 .21 0.504 907 2 739 906 42.0 221.244 7.18 2.06 0.078 0.046 0.5 0.073 0.468 0.00-.15-.00-.04 .48 .33 .17 0.630 848 0 747 840 42.9 207.835 7.05 2.06 0.080 0.038 0.5 0.000 0.000 0.00-.15-.04 .01 .51 .33 .17 0.756 840 67 614 832 45.7 167.427 5.88 2.07 0.088 0.018 0.5 0.084 0.197 1.01-.10 .02 .01 .48 .33 .17 0.882 847 682 758 846 46.9 174.654 6.34 2.05 0.076 -0.013 0.5 0.085 0.085 0.74-.06 .00-.00 .48 .31 .17 1.008 896 686 792 896 45.5 192.985 6.71 2.07 0.072 -0.005 0.5 0.066 0.072 0.69-.13 .01 .01 .48 .33 .16 1.134 916 515 704 916 42.1 207.864 6.81 2.10 0.071 -0.005 0.5 0.067 0.063 0.58-.14 .02 .01 .49 .31 .17 1.260 828 105 511 827 45.3 212.534 7.24 2.12 0.073 -0.025 0.5 0.067 0.052 0.70-.11-.03 .02 .48 .34 .17 1.386 903 22 786 895 48.2 212.169 7.08 2.13 0.068 -0.017 0.5 0.064 0.540 0.96-.09-.10-.01 .47 .34 .17 1.512 852 2 816 845 44.6 202.255 6.79 2.11 0.070 -0.022 0.4 0.067 0.161 0.48-.09-.08-.04 .49 .35 .18 1.638 843 0 746 838 48.8 197.062 6.70 2.12 0.076 -0.017 0.5 0.000 0.000 0.00-.12 .02-.02 .47 .33 .19 1.764 919 0 880 909 47.0 200.441 6.50 2.13 0.075 0.006 0.5 0.000 0.000 0.00 .01 .12-.06 .45 .35 .18 1.890 841 0 756 827 47.1 199.181 6.67 2.13 0.074 -0.019 0.5 0.000 0.000 0.00 .05 .12-.04 .47 .39 .18 2.016 907 22 567 882 46.0 203.756 6.84 2.13 0.075 0.009 0.5 0.066 0.258 0.96-.00 .11-.05 .50 .36 .19 2.142 843 123 690 836 43.2 196.693 6.56 2.13 0.076 0.010 0.5 0.071 0.249 1.20-.06-.01-.03 .47 .35 .17 2.268 918 22 811 911 46.2 217.972 7.26 2.12 0.075 0.020 0.5 0.067 0.157 0.74-.11-.06-.01 .46 .33 .16 2.394 908 202 763 894 48.9 189.703 6.53 2.12 0.077 0.013 0.5 0.072 0.039 0.64-.10 .02 .01 .46 .33 .17 2.520 Batch# # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 1.000 5933 8 2369 5908 45.2 202.768 6.83 2.08 0.081 0.009 0.5 0.074 0.515 0.97-.09 .06-.03 .49 .36 .18 2.000 5777 2076 2400 5757 45.7 199.439 6.81 2.10 0.072 -0.015 0.5 0.069 0.074 0.68-.10-.02-.00 .48 .33 .17 3.000 5821 369 2410 5740 46.6 201.806 6.75 2.13 0.075 0.005 0.5 0.068 0.063 0.77-.04 .04-.03 .47 .35 .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 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 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 12.000 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 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 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 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 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 17.000 Correl # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 1920 327 843 1880100.0 1.423 0.08 2.04 1.192 -4.211 0.5 1.093 1.175 0.80 .01-.02-.01 .67 .46 .24 0.100 874 135 640 859100.0 10.169 0.50 2.05 0.661 -0.215 0.4 0.611 0.736 0.81-.03 .04-.01 .62 .46 .24 0.200 993 153 712 978 99.7 15.380 0.71 2.04 0.494 -0.106 0.3 0.476 0.536 0.89-.01 .02-.01 .63 .46 .23 0.300 981 152 693 966 98.2 22.658 0.99 2.04 0.368 -0.007 0.4 0.343 0.350 0.80-.04 .02-.02 .61 .44 .21 0.400 1190 186 765 1173 96.2 29.530 1.23 2.05 0.309 0.008 0.4 0.286 0.303 0.83-.04 .02 .00 .59 .41 .21 0.500 1021 168 697 1014 82.8 41.496 1.63 2.06 0.244 0.007 0.4 0.219 0.210 0.73-.11 .02-.01 .54 .40 .20 0.600 1498 221 866 1489 56.9 59.043 2.11 2.07 0.205 0.002 0.4 0.184 0.188 0.78-.12 .04-.02 .49 .38 .18 0.700 1693 237 899 1686 21.3 98.000 3.20 2.09 0.141 -0.017 0.4 0.130 0.122 0.74-.20 .04-.02 .44 .32 .16 0.800 3764 580 1175 3763 2.2 264.892 7.16 2.13 0.072 -0.005 0.5 0.066 0.056 0.67-.18 .05-.03 .37 .26 .12 0.900 3597 294 772 3597 0.0 598.235 15.99 2.19 0.046 0.010 0.7 0.044 0.032 0.58-.00 .03-.04 .20 .18 .12 1.000 Missing # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 17531 2453 2741 17405 45.8 201.350 6.79 2.10 0.076 0.000 0.5 0.071 0.072 0.70-.08 .03-.02 .48 .35 .18 0.020 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 0.040 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 0.060 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 0.080 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 0.100 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 0.120 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 0.140 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 0.160 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 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 0.200 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 0.220 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 0.240 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 0.280 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 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 88.885 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 .00 177.770 178 28 159 177 51.7 55.059 2.54 2.13 0.163 -0.067 0.4 0.149 0.158 0.86-.18 .09 .00 .56 .42 .02 355.539 7016 1232 1814 7009 52.4 71.234 2.76 2.09 0.159 -0.035 0.4 0.144 0.131 0.73-.11 .03-.02 .52 .35 .20 711.078 8953 1108 2352 8849 46.9 160.318 5.17 2.08 0.092 0.004 0.5 0.085 0.083 0.71-.07 .03-.02 .47 .37 .16 1422.156 918 55 363 904 6.6 704.684 17.96 2.20 0.041 0.009 0.7 0.039 0.029 0.60 .02 .03-.05 .18 .18 .13 2844.312 294 16 124 294 1.0 1312.027 32.37 2.33 0.031 0.010 1.0 0.028 0.016 0.49 .03 .01-.05 .14 .12 .16 5688.625 113 9 46 113 0.0 2640.248 52.61 2.58 0.035 -0.007 1.7 0.033 0.022 0.52 .03-.01-.05 .13 .08 .20 11377.250 56 5 22 56 0.0 4256.938 69.87 2.74 0.029 0.017 1.9 0.028 0.023 0.59 .02 .00-.06 .07 .06 .15 22754.500 3 0 2 3 0.0 5207.934 89.13 2.66 0.037 0.036 2.9 0.000 0.000 0.00 .06 .07-.26 .18 .07 .40 45509.000 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 0.307 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 0.614 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 0.921 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 1.228 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 1.536 136 34 116 125 79.4 31.309 1.37 1.81 0.340 0.092 0.5 0.346 0.347 0.78-.03-.01-.01 .67 .46 .22 1.843 13172 2128 2570 13064 52.8 120.193 4.21 2.06 0.109 0.004 0.4 0.100 0.108 0.74-.09 .03-.02 .51 .37 .18 2.150 3855 248 1467 3848 24.4 324.908 9.99 2.21 0.058 -0.006 0.5 0.055 0.031 0.53-.06 .03-.03 .38 .28 .15 2.457 255 31 69 255 8.6 1462.622 39.18 2.60 0.030 0.006 0.9 0.028 0.022 0.62 .05-.00-.04 .21 .17 .14 2.764 113 12 35 113 3.5 2804.967 56.85 2.86 0.032 -0.008 1.5 0.032 0.018 0.43 .01 .02-.04 .19 .13 .14 3.071 ErrX # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ -1.500 102 21 100 100 98.0 15.273 0.68 2.02 0.521 -0.180 0.4 0.472 0.510 0.89-1.6 .09-.11 1.6 .52 .37 -1.380 73 12 69 71 87.7 30.032 1.18 2.02 0.373 -0.002 0.4 0.361 0.260 0.70-1.3-.11-.10 1.3 .48 .32 -1.260 102 20 100 101 88.2 22.405 0.97 2.04 0.362 -0.077 0.4 0.351 0.374 0.84-1.2-.06-.06 1.2 .45 .29 -1.140 154 34 147 152 88.3 27.803 1.16 2.04 0.339 -0.056 0.4 0.302 0.281 0.77-1.1-.02-.07 1.1 .52 .29 -1.020 239 45 226 236 79.5 39.921 1.62 2.05 0.229 0.000 0.4 0.195 0.255 0.88-.96 .02-.09 .96 .40 .27 -0.900 358 57 325 352 64.2 63.694 2.33 2.07 0.173 -0.028 0.4 0.148 0.179 0.80-.84 .01-.07 .84 .39 .24 -0.780 654 98 563 650 52.3 97.960 3.33 2.08 0.125 -0.012 0.4 0.115 0.099 0.66-.72 .03-.04 .72 .38 .20 -0.660 905 136 710 899 46.3 128.805 4.08 2.08 0.112 0.000 0.4 0.104 0.105 0.70-.59 .02-.04 .59 .33 .17 -0.540 1209 180 880 1207 41.3 134.613 4.22 2.09 0.112 -0.008 0.5 0.103 0.089 0.72-.48 .04-.04 .48 .34 .17 -0.420 1464 223 1009 1458 39.0 128.578 4.13 2.09 0.111 -0.009 0.4 0.103 0.095 0.72-.36 .03-.03 .36 .33 .16 -0.300 1595 218 1122 1585 37.9 142.028 4.72 2.09 0.103 -0.003 0.5 0.095 0.103 0.69-.24 .05-.04 .24 .34 .15 -0.180 1944 241 1303 1940 36.2 210.253 7.16 2.12 0.076 0.009 0.5 0.070 0.107 0.81-.12 .04-.03 .13 .30 .15 -0.060 2617 336 1380 2605 26.4 451.408 13.48 2.16 0.049 0.005 0.6 0.046 0.038 0.65 .00 .02-.02 .04 .28 .13 0.060 1910 237 1161 1900 31.2 358.864 11.27 2.14 0.053 0.000 0.5 0.050 0.036 0.53 .12 .03-.02 .12 .29 .14 0.180 1270 145 964 1258 43.5 216.188 7.51 2.09 0.072 -0.004 0.5 0.066 0.113 0.78 .23 .04-.03 .24 .34 .16 0.300 904 123 757 887 57.6 118.112 4.50 2.07 0.105 -0.008 0.4 0.095 0.176 0.81 .35 .04 .01 .36 .39 .18 0.420 559 103 499 549 72.8 58.638 2.41 2.06 0.177 0.011 0.4 0.155 0.302 0.82 .48 .01 .03 .48 .43 .20 0.540 420 62 384 418 82.9 36.336 1.53 2.05 0.255 -0.013 0.4 0.225 0.334 0.95 .60-.01 .04 .60 .41 .21 0.660 322 55 295 318 87.3 29.402 1.25 2.05 0.291 -0.011 0.4 0.277 0.290 0.62 .71 .04 .05 .71 .44 .24 0.780 193 22 183 190 90.2 24.361 1.03 2.05 0.340 0.000 0.4 0.339 0.282 0.72 .84 .02 .05 .84 .50 .25 0.900 184 25 176 181 92.9 22.000 0.95 2.05 0.414 -0.088 0.4 0.368 0.435 0.72 .96-.00 .08 .96 .49 .27 1.020 122 20 118 120 94.3 21.132 0.93 2.06 0.389 -0.168 0.4 0.360 0.476 1.03 1.1 .00 .11 1.1 .53 .27 1.140 69 13 68 69 98.6 19.189 0.84 2.03 0.407 -0.148 0.4 0.400 0.471 0.73 1.2-.01 .13 1.2 .49 .32 1.260 54 8 54 54100.0 12.884 0.60 2.02 0.547 -0.206 0.4 0.583 0.531 0.70 1.3 .04 .11 1.3 .57 .30 1.380 108 19 102 105 99.1 12.901 0.57 2.06 0.642 -0.233 0.4 0.525 0.472 0.59 1.6-.00 .09 1.6 .52 .36 1.500 ErrY # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ -1.500 14 1 14 14100.0 9.512 0.53 2.02 0.721 -0.450 0.5 0.529 0.403 1.18 .55-1.6 .11 .77 1.6 .32 -1.380 8 1 8 8100.0 9.757 0.50 2.02 0.648 -0.691 0.5 0.588 0.770 1.73 .11-1.3-.00 .63 1.3 .29 -1.260 28 3 28 27 96.4 15.317 0.71 2.02 0.541 -0.161 0.4 0.468 0.243 0.63 .08-1.2-.05 .91 1.2 .34 -1.140 35 3 35 33 94.3 15.609 0.74 2.04 0.452 -0.089 0.4 0.389 1.308 1.01 .10-1.1 .01 .73 1.1 .28 -1.020 69 9 66 66 95.7 15.564 0.75 2.05 0.474 -0.169 0.4 0.447 0.521 0.64-.12-.96-.03 .73 .96 .29 -0.900 134 15 127 131 91.0 25.232 1.13 2.05 0.340 -0.093 0.4 0.325 0.308 0.97-.01-.83-.02 .66 .83 .26 -0.780 248 45 237 243 87.5 27.006 1.19 2.05 0.296 0.007 0.4 0.281 0.323 0.69-.04-.71-.02 .64 .71 .25 -0.660 400 69 358 393 80.0 36.406 1.56 2.05 0.253 -0.038 0.4 0.239 0.339 0.81-.02-.60 .02 .59 .60 .23 -0.540 606 87 538 599 72.4 47.725 1.92 2.06 0.208 -0.007 0.4 0.188 0.250 0.93-.04-.47-.01 .56 .47 .20 -0.420 970 139 778 963 58.8 76.065 2.86 2.07 0.148 -0.020 0.4 0.135 0.157 0.71-.09-.35-.01 .53 .36 .18 -0.300 1619 227 1218 1612 47.7 135.819 4.78 2.09 0.095 -0.003 0.4 0.088 0.124 0.78-.11-.24-.01 .48 .24 .17 -0.180 2356 350 1487 2343 35.3 256.089 8.24 2.12 0.065 0.004 0.5 0.062 0.060 0.71-.10-.12-.01 .44 .12 .15 -0.060 3306 500 1691 3294 29.7 380.284 11.61 2.15 0.054 0.005 0.6 0.051 0.042 0.61-.09 .00-.02 .40 .04 .15 0.060 2548 366 1559 2544 33.9 263.781 8.27 2.12 0.068 0.002 0.5 0.063 0.065 0.66-.09 .12-.03 .44 .13 .16 0.180 1842 229 1298 1831 40.8 178.271 5.79 2.10 0.088 -0.004 0.5 0.081 0.121 0.74-.07 .24-.04 .46 .24 .17 0.300 1347 163 1069 1337 50.6 131.355 4.49 2.09 0.108 -0.007 0.5 0.097 0.160 0.70-.08 .36-.04 .49 .36 .19 0.420 810 109 701 801 59.3 90.154 3.27 2.07 0.127 -0.015 0.4 0.113 0.262 0.92-.08 .48-.04 .52 .48 .20 0.540 512 63 462 509 63.3 77.788 2.85 2.07 0.156 -0.027 0.4 0.143 0.236 0.70-.05 .59-.01 .53 .59 .20 0.660 322 34 299 314 72.4 56.982 2.24 2.07 0.191 -0.032 0.4 0.163 0.289 0.68-.04 .71 .00 .56 .72 .22 0.780 164 21 159 157 79.3 34.298 1.48 2.06 0.270 -0.106 0.4 0.234 0.289 0.81-.08 .84-.04 .63 .84 .23 0.900 100 10 100 96 82.0 33.738 1.36 2.05 0.289 -0.054 0.4 0.254 0.436 0.61-.05 .95-.03 .58 .96 .25 1.020 49 2 48 48 85.7 32.387 1.41 2.04 0.277 -0.058 0.4 0.235 1.602 1.09-.11 1.1 .01 .78 1.1 .26 1.140 20 2 20 20 95.0 14.721 0.75 2.08 0.376 -0.208 0.3 0.389 1.627 0.40 .21 1.2 .14 .88 1.2 .32 1.260 12 3 12 10100.0 14.734 0.63 2.03 0.482 -0.560 0.4 0.638 0.351 0.77 .38 1.3 .10 .98 1.3 .30 1.380 12 2 12 12 91.7 12.394 0.65 2.06 0.550 -0.708 0.6 0.463 0.569 2.25-.35 1.5-.01 .95 1.5 .26 1.500 ErrZ # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ -1.500 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 -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 1 0 1 1 0.0 696.878 43.19 2.68 0.073 -0.073 3.2 0.000 0.000 0.00 .06 .02-.91 .06 .02 .91 -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 -0.780 1 0 1 1 0.0 331.659 25.01 2.12 0.047 0.047 1.2 0.000 0.000 0.00-.48 .12-.69 .48 .12 .69 -0.660 17 2 16 17 76.5 342.905 16.25 2.13 0.033 0.000 0.6 0.028 0.123 0.09-.28-.18-.58 .91 .43 .58 -0.540 198 30 188 197 96.5 33.088 1.61 2.06 0.254 -0.109 0.5 0.227 0.651 0.77-.37 .03-.46 .94 .53 .47 -0.420 807 103 680 800 82.4 78.685 3.38 2.07 0.121 -0.015 0.4 0.108 0.310 0.70-.22 .02-.35 .73 .46 .35 -0.300 2039 201 1375 2022 52.0 194.106 6.74 2.10 0.075 0.002 0.5 0.068 0.274 0.87-.15 .07-.23 .51 .38 .23 -0.180 3864 401 1949 3843 35.6 231.567 7.36 2.11 0.070 0.001 0.5 0.065 0.070 0.71-.11 .05-.11 .39 .32 .12 -0.060 5651 860 2154 5615 30.2 272.551 8.33 2.12 0.068 -0.002 0.5 0.063 0.055 0.65-.09 .02-.00 .37 .28 .04 0.060 2801 488 1729 2782 45.0 186.250 6.39 2.10 0.081 0.006 0.5 0.075 0.066 0.67-.05 .01 .11 .43 .33 .12 0.180 1348 240 1036 1333 74.7 58.569 2.43 2.06 0.168 0.007 0.4 0.151 0.171 0.83 .05 .01 .23 .59 .43 .24 0.300 633 96 531 623 91.9 29.549 1.35 2.06 0.283 -0.024 0.4 0.250 0.346 0.90 .15-.00 .35 .79 .51 .35 0.420 162 31 147 162 99.4 18.006 0.92 2.06 0.401 -0.114 0.4 0.346 0.527 0.75 .22-.00 .46 .97 .54 .46 0.540 8 1 8 8100.0 -2.568 -0.15 2.06 1.446 -3.696 0.7 1.171 2.753 1.26 .90-.02 .57 1.2 .38 .57 0.660 1 0 1 1100.0 3.442 0.21 2.09 0.649 -0.649 0.1 0.000 0.000 0.00 1.7 1.2 .66 1.7 1.2 .66 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 #Equivs # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 126 0 126 0 86.5 32.923 1.15 1.99 0.000 0.000 0.0 0.000 0.000 0.00 .01 .05 .00 .63 .56 .19 1.000 336 53 168 336 79.5 53.654 1.91 2.03 0.162 0.000 0.3 0.000 0.477 0.00-.01 .06-.01 .59 .43 .21 2.000 381 98 127 381 77.4 126.311 4.85 2.11 0.093 0.000 0.4 0.124 0.154 0.89 .05 .03 .01 .59 .42 .20 3.000 1344 324 336 1344 66.9 102.122 3.70 2.07 0.105 0.000 0.4 0.094 0.127 1.09-.05 .04-.01 .57 .40 .20 4.000 960 192 192 960 63.3 129.371 4.86 2.09 0.092 0.000 0.4 0.081 0.086 0.81-.07 .03-.02 .51 .39 .19 5.000 3948 652 658 3948 64.9 142.642 5.21 2.08 0.095 0.000 0.5 0.086 0.085 0.76-.06 .02-.02 .55 .37 .20 6.000 1323 189 189 1323 58.4 85.385 3.00 2.07 0.139 0.000 0.4 0.125 0.123 0.74-.11 .04-.02 .51 .40 .18 7.000 2816 352 352 2816 47.0 100.321 3.41 2.07 0.134 0.000 0.4 0.124 0.099 0.64-.13 .03-.01 .51 .36 .18 8.000 963 107 107 963 38.8 140.540 4.55 2.09 0.100 0.000 0.4 0.095 0.066 0.53-.18 .03-.02 .47 .34 .16 9.000 5334 486 486 5334 15.4 394.486 11.98 2.16 0.055 0.000 0.6 0.052 0.035 0.50-.07 .03-.03 .33 .26 .14 10.000 Angstms # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 9999.000 2913 320 331 2912 7.9 666.717 20.37 2.26 0.040 0.000 0.7 0.038 0.026 0.53 .03 .02-.04 .22 .20 .14 1.617 2543 292 297 2543 16.2 265.344 8.29 2.11 0.071 0.000 0.5 0.067 0.059 0.67-.08 .04-.03 .32 .28 .14 1.283 2193 280 293 2191 26.3 161.953 5.11 2.12 0.095 0.000 0.5 0.090 0.076 0.66-.22 .04-.02 .43 .32 .14 1.121 1978 274 287 1976 32.4 117.359 3.72 2.10 0.119 0.000 0.4 0.110 0.106 0.76-.20 .04-.03 .44 .34 .16 1.019 1788 267 285 1787 50.7 77.135 2.62 2.08 0.155 0.000 0.4 0.140 0.142 0.86-.15 .04-.02 .48 .37 .19 0.946 1644 261 275 1642 79.3 36.106 1.46 2.05 0.256 0.000 0.4 0.236 0.204 0.72-.03 .01-.01 .56 .41 .22 0.890 1507 253 275 1499 88.2 27.967 1.14 2.03 0.330 0.000 0.4 0.298 0.308 0.77-.06 .02-.01 .61 .42 .22 0.845 1521 258 284 1513 88.5 28.902 1.09 2.02 0.343 0.000 0.4 0.317 0.314 0.78-.02 .00-.01 .65 .43 .22 0.809 1173 206 265 1147 89.3 29.048 1.04 2.00 0.383 0.000 0.4 0.351 0.385 0.85 .01 .02-.00 .68 .45 .21 0.777 271 42 149 195 88.9 30.335 1.05 1.96 0.321 0.000 0.4 0.332 0.531 1.23 .00 .01 .00 .65 .53 .19 0.751 Intens # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 3192 498 1010 3150100.0 2.703 0.15 2.06 1.149 -1.880 0.4 1.050 1.181 0.79-.00 .00-.01 .64 .46 .24 12.539 1944 313 962 1915 99.0 18.622 0.87 2.05 0.400 -0.025 0.4 0.373 0.422 0.84-.04 .01-.01 .59 .43 .22 25.078 2754 423 1041 2728 87.4 36.625 1.50 2.06 0.257 0.018 0.4 0.232 0.251 0.81-.07 .03-.01 .54 .39 .20 50.156 2863 406 830 2843 17.8 71.717 2.52 2.08 0.168 0.016 0.4 0.153 0.151 0.74-.13 .03-.02 .44 .33 .16 100.312 2553 331 574 2545 0.0 143.518 4.28 2.11 0.114 0.006 0.5 0.105 0.099 0.72-.16 .05-.03 .36 .27 .12 200.625 2050 244 345 2049 0.0 279.730 7.21 2.14 0.074 0.008 0.5 0.069 0.062 0.69-.15 .04-.04 .33 .22 .11 401.250 1283 140 193 1283 0.0 566.390 12.94 2.18 0.050 0.002 0.7 0.049 0.035 0.54-.06 .05-.05 .26 .20 .12 802.500 588 64 79 588 0.0 1084.606 20.61 2.23 0.038 0.003 0.8 0.036 0.031 0.65 .02 .03-.05 .18 .17 .13 1605.000 226 25 28 226 0.0 2184.577 36.08 2.42 0.031 0.003 1.2 0.029 0.017 0.42 .04 .02-.05 .11 .11 .14 3210.000 78 9 10 78 0.0 4883.098 63.80 2.75 0.033 0.000 2.1 0.033 0.023 0.58 .02 .01-.05 .08 .08 .14 6420.000 #Sigmas # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 6739 1052 1550 6641100.0 14.880 0.70 2.05 0.481 -0.147 0.4 0.439 0.500 0.84-.02 .01-.01 .62 .44 .23 1.575 2511 388 838 2495 51.5 54.019 2.01 2.07 0.203 0.022 0.4 0.183 0.180 0.73-.12 .02-.01 .48 .36 .18 2.480 2370 355 632 2358 0.0 98.001 3.14 2.09 0.142 0.014 0.4 0.131 0.124 0.73-.16 .05-.02 .39 .31 .13 3.904 2107 270 455 2107 0.0 179.877 4.97 2.12 0.099 -0.001 0.5 0.091 0.081 0.73-.21 .06-.03 .36 .26 .11 6.148 1339 147 309 1339 0.0 286.129 7.73 2.14 0.074 0.008 0.6 0.070 0.055 0.65-.12 .04-.04 .31 .21 .11 9.681 1286 133 254 1286 0.0 494.693 12.17 2.16 0.052 -0.001 0.6 0.050 0.037 0.58-.02 .04-.04 .23 .19 .11 15.244 671 63 143 671 0.0 868.492 18.63 2.21 0.040 0.002 0.7 0.039 0.027 0.55 .05 .02-.05 .14 .16 .12 24.004 314 26 82 314 0.0 1421.447 29.70 2.35 0.033 0.008 1.0 0.031 0.018 0.50 .04 .02-.05 .14 .11 .15 37.799 120 11 39 120 0.0 2485.586 47.56 2.58 0.032 -0.004 1.5 0.030 0.016 0.42 .03-.00-.04 .10 .08 .17 59.520 74 8 19 74 0.0 4541.153 68.69 2.77 0.030 0.009 2.0 0.031 0.026 0.60 .03 .01-.07 .09 .06 .16 93.723 Rsym # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 2572 345 1196 2558 14.5 526.498 14.09 2.17 0.014 0.000 0.2 0.020 0.032 0.56-.07 .03-.03 .34 .25 .14 0.030 2157 248 1140 2150 15.3 405.490 11.17 2.15 0.044 0.006 0.4 0.044 0.044 0.68-.09 .03-.03 .37 .26 .14 0.060 1704 203 1072 1700 20.5 279.496 8.21 2.12 0.073 0.009 0.5 0.067 0.063 0.65-.10 .05-.03 .40 .29 .15 0.090 1423 193 993 1422 25.2 195.839 6.10 2.11 0.103 0.016 0.5 0.091 0.087 0.70-.12 .04-.03 .42 .30 .15 0.120 1106 152 852 1104 29.8 146.820 4.71 2.09 0.134 0.010 0.5 0.118 0.103 0.71-.12 .03-.02 .44 .33 .16 0.150 863 124 699 860 36.0 106.511 3.62 2.09 0.164 0.004 0.5 0.145 0.116 0.72-.13 .02-.02 .48 .33 .17 0.180 727 108 621 723 43.3 92.367 3.23 2.08 0.194 0.003 0.6 0.170 0.152 0.93-.12 .03-.01 .46 .35 .16 0.210 646 85 556 636 48.3 77.872 2.83 2.08 0.224 0.007 0.6 0.197 0.175 0.80-.12 .06-.01 .47 .37 .18 0.240 553 95 486 552 53.5 65.807 2.42 2.07 0.254 0.013 0.5 0.218 0.186 0.83-.09 .02-.02 .49 .37 .19 0.270 519 87 457 512 59.7 58.033 2.16 2.06 0.284 0.020 0.6 0.241 0.208 0.86-.08 .06-.01 .50 .39 .19 0.300 401 53 369 398 68.1 48.495 1.92 2.07 0.315 0.018 0.6 0.271 0.239 0.76-.09 .02-.00 .51 .39 .18 0.330 367 55 338 358 68.9 46.354 1.82 2.06 0.345 0.015 0.6 0.303 0.214 0.82-.04 .02-.02 .51 .39 .18 0.360 294 33 273 293 77.6 38.408 1.55 2.06 0.374 0.024 0.5 0.320 0.288 0.88-.03 .04-.02 .53 .35 .21 0.390 247 40 233 247 74.9 40.928 1.66 2.06 0.406 -0.021 0.6 0.344 0.238 0.80-.10 .06-.01 .56 .40 .22 0.420 238 46 225 237 79.4 36.525 1.47 2.06 0.434 0.020 0.6 0.376 0.325 1.05-.08 .06-.03 .51 .41 .21 0.450 200 29 188 200 87.0 28.097 1.26 2.05 0.464 0.041 0.6 0.391 0.364 0.84-.06 .03 .01 .58 .44 .22 0.480 202 39 193 198 92.6 26.303 1.15 2.05 0.495 0.062 0.6 0.407 0.337 0.71-.13 .01-.02 .57 .40 .21 0.510 171 32 161 169 92.4 24.263 1.08 2.05 0.525 0.105 0.5 0.441 0.366 0.68-.06 .07 .01 .57 .41 .22 0.540 176 29 167 174 94.3 23.985 1.07 2.06 0.555 0.050 0.6 0.463 0.383 0.89-.08 .04-.03 .58 .45 .22 0.570 2965 457 1304 2914 99.0 7.432 0.38 2.05 1.148 -0.890 0.6 0.983 0.792 0.73-.00-.00-.01 .66 .46 .24 0.600 dI/I # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ -0.500 2574 366 1410 2531 98.0 7.478 0.38 2.06 1.104 -1.628 0.6 0.949 0.833 0.76-.02 .01-.01 .65 .46 .24 -0.460 124 23 122 123 75.8 38.752 1.58 2.07 0.436 -0.437 0.6 0.376 0.351 1.19-.05 .08-.02 .49 .41 .19 -0.420 156 19 156 156 70.5 41.943 1.75 2.09 0.401 -0.404 0.6 0.343 0.231 0.78-.10 .08-.01 .49 .38 .20 -0.380 202 25 195 201 69.3 44.779 1.77 2.07 0.358 -0.358 0.6 0.310 0.415 1.18-.09 .07-.04 .52 .38 .18 -0.340 223 27 214 221 62.8 54.516 2.16 2.08 0.320 -0.321 0.6 0.279 0.256 0.90-.06 .03-.01 .51 .39 .17 -0.300 300 49 284 298 56.7 63.903 2.38 2.09 0.278 -0.279 0.6 0.233 0.188 0.80-.10 .10-.03 .45 .41 .17 -0.260 355 41 327 354 45.4 80.133 2.99 2.10 0.238 -0.238 0.6 0.207 0.176 0.80-.12 .06 .00 .47 .35 .18 -0.220 435 57 394 432 44.4 94.404 3.38 2.10 0.197 -0.197 0.6 0.174 0.156 0.85-.12 .03-.02 .45 .37 .17 -0.180 547 75 475 546 34.9 114.622 3.90 2.10 0.159 -0.159 0.5 0.142 0.105 0.61-.13 .03-.02 .46 .32 .15 -0.140 723 99 615 723 31.7 167.033 5.41 2.11 0.119 -0.119 0.5 0.107 0.080 0.59-.13 .03-.02 .44 .33 .16 -0.100 1014 143 795 1011 20.3 262.744 7.73 2.13 0.077 -0.077 0.5 0.071 0.063 0.68-.13 .05-.04 .41 .30 .14 -0.060 1365 193 892 1364 15.1 422.622 11.51 2.16 0.038 -0.038 0.3 0.039 0.041 0.64-.09 .02-.03 .36 .26 .13 -0.020 1778 241 972 1767 13.8 529.871 14.07 2.18 0.010 0.000 0.1 0.018 0.030 0.54-.07 .03-.03 .34 .25 .14 0.020 1586 159 965 1577 15.8 447.545 12.38 2.15 0.038 0.038 0.4 0.038 0.044 0.69-.09 .03-.03 .36 .25 .14 0.060 1203 143 892 1201 20.4 277.124 8.22 2.11 0.078 0.078 0.5 0.069 0.078 0.68-.09 .03-.03 .39 .28 .15 0.100 939 115 763 937 26.0 164.609 5.12 2.09 0.118 0.118 0.5 0.105 0.103 0.75-.11 .04-.02 .43 .32 .16 0.140 670 97 585 668 34.9 106.578 3.58 2.08 0.157 0.157 0.5 0.137 0.132 0.86-.13 .02-.02 .47 .34 .17 0.180 537 84 484 531 47.1 82.383 2.88 2.07 0.199 0.198 0.5 0.175 0.162 0.99-.12 .04-.01 .49 .35 .17 0.220 425 73 385 421 50.4 68.898 2.45 2.06 0.239 0.238 0.5 0.206 0.159 0.74-.08 .03-.02 .49 .39 .18 0.260 393 71 361 387 61.6 55.373 2.06 2.04 0.280 0.279 0.5 0.241 0.234 0.94-.06 .01-.00 .52 .36 .19 0.300 289 39 269 287 71.3 45.954 1.79 2.05 0.319 0.315 0.5 0.276 0.200 0.60-.08-.02-.00 .51 .39 .19 0.340 250 40 235 242 74.0 40.846 1.62 2.05 0.359 0.353 0.5 0.312 0.191 0.79 .00 .04-.01 .54 .38 .20 0.380 189 31 179 189 83.6 35.036 1.42 2.04 0.401 0.401 0.5 0.335 0.256 0.76-.07 .01-.00 .57 .38 .23 0.420 179 34 169 179 84.4 32.018 1.31 2.05 0.438 0.441 0.5 0.374 0.324 0.88-.06 .02-.03 .53 .42 .22 0.460 1075 209 664 1059 96.9 18.833 0.87 2.04 0.643 0.626 0.5 0.529 0.438 0.70-.02-.00-.00 .62 .44 .23 0.500 dI/sig # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 15746 2256 2737 15622 48.5 159.788 5.52 2.09 0.069 0.002 0.4 0.065 0.078 0.68-.08 .03-.02 .49 .36 .18 1.000 1613 184 976 1611 23.9 442.866 12.84 2.14 0.100 -0.008 1.3 0.090 0.055 0.75-.07 .04-.03 .40 .30 .16 2.000 133 11 104 133 9.0 1358.566 30.38 2.30 0.078 -0.004 2.4 0.070 0.049 0.73-.01 .06-.02 .27 .22 .13 3.000 25 2 18 25 0.0 2333.749 50.85 2.54 0.069 0.010 3.4 0.062 0.041 0.85 .04 .03-.05 .12 .09 .24 4.000 6 0 6 6 0.0 2932.667 51.48 2.40 0.089 0.032 4.6 0.000 0.000 0.00 .13 .03-.12 .17 .10 .16 5.000 4 0 3 4 0.0 5395.875 73.14 2.72 0.077 0.029 5.7 0.000 0.000 0.00-.05-.01 .12 .08 .04 .14 6.000 1 0 1 1 0.0 4856.200 57.81 2.68 0.106 -0.106 6.1 0.000 0.000 0.00 .23 .04 .01 .23 .04 .01 7.000 2 0 2 2 0.0 5055.150 59.40 2.79 0.129 -0.129 7.7 0.000 0.000 0.00 .14 .14-.01 .17 .17 .02 8.000 1 0 1 1 0.0 6343.300 87.61 2.80 0.096 0.096 8.4 0.000 0.000 0.00-.02 .07 .14 .02 .07 .14 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 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 12.000 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 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 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 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 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 17.000 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 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 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 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 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 23.000 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 24.000 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 25.000 Overall # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 17531 2453 2741 17405 45.8 201.350 6.79 2.10 0.076 0.000 0.5 0.071 0.072 0.70-.08 .03-.02 .48 .35 .18 1.000 Centric # Pairs Uniq Merg %<2s <#Sig> Rsym dI/I dI/s R+ Ranom Canom ErX ErY ErZ RmX RmY RmZ 0.000 2554 497 645 2507 47.6 273.114 9.97 2.15 0.055 0.000 0.5 0.049 0.058 0.80-.05 .03-.02 .45 .35 .18 1.000 Coverage Statistics for jsib001t.raw .......Shell...... Angstrms #Obs Theory %Compl Redund Rsym Pairs %Pairs Rshell #Sigma %<2s to 1.617 331 332 99.70 8.80 0.040 320 96.39 0.040 20.37 7.9 to 1.283 628 629 99.84 8.69 0.048 612 97.30 0.071 8.29 16.2 to 1.121 921 923 99.78 8.31 0.053 892 96.64 0.095 5.11 26.3 to 1.019 1208 1210 99.83 7.97 0.058 1166 96.36 0.119 3.72 32.4 to 0.946 1493 1496 99.80 7.65 0.062 1433 95.79 0.155 2.62 50.7 to 0.890 1768 1771 99.83 7.39 0.066 1694 95.65 0.256 1.46 79.3 to 0.845 2043 2053 99.51 7.13 0.069 1947 94.84 0.330 1.14 88.2 to 0.809 2327 2337 99.57 6.91 0.073 2205 94.35 0.343 1.09 88.5 to 0.777 2592 2612 99.23 6.66 0.076 2411 92.30 0.383 1.04 89.3 to 0.751 2741 2898 94.58 6.40 0.076 2453 84.64 0.321 1.05 88.9