#!/bin/sh

# Collect -D & -m options as java arguments
command=java
while [ `echo $1 | egrep '^-D|^-m' | wc -l` != 0 ]; do
	command="$command $1"
	shift
done

# Determine installation location
if [ "$JMOL_HOME" = "" ]; then
	binDir=${0%/*}
	if [ "$binDir" = "$0" ]; then
		# Ran from local directory
		binDir=$PWD
	fi
	# Resolve symlinks.
	program="$0"
	while [ -L "$program" ]; do
		ls=`/bin/ls -ld "$program"`
		link=`/usr/bin/expr "$ls" : '.*-> \(.*\)$'`
		if /usr/bin/expr "$link" : '.*/.*' > /dev/null; then
		program="$link"
		else
		program="`/usr/bin/dirname $program`/$link"
		fi
	done
	binDir=`dirname $program`
fi

JMOL_HOME=${JMOL_HOME:-$binDir}
libDir=${JMOL_HOME}/jars

if [ ! -e ${JMOL_HOME}/Jmol.jar ]; then
	echo "Jmol could not find its installed files."
	exit
fi

$command -Djmol.home="$JMOL_HOME" -jar ${JMOL_HOME}/Jmol.jar "$@"
                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                        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                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                               t(targetSuffix);
  if (!applet)return "ERROR: NO APPLET"
  return applet.loadInlineString(model, script, false);
}


function jmolLoadInlineArray(ModelArray, script, targetSuffix) {
  if (!model)return "ERROR: NO MODEL"
  if (!script)script=""
  var applet=_jmolGetApplet(targetSuffix);
  if (!applet)return "ERROR: NO APPLET"
  try {
    return applet.loadInlineArray(ModelArray, script, false);
  } catch (err) {
    //IE 7 bug
    return applet.loadInlineString(ModelArray.join("\n"), script, false);
  }
}

function jmolAppendInlineArray(ModelArray, script, targetSuffix) {
  if (!model)return "ERROR: NO MODEL"
  if (!script)script=""
  var applet=_jmolGetApplet(targetSuffix);
  if (!applet)return "ERROR: NO APPLET"
  try {
    return applet.loadInlineArray(ModelArray, script, true);
  } catch (err) {
    //IE 7 bug
    return applet.loadInlineString(ModelArray.join("\n"), script, true);
  }
}

function jmolAppendInlineScript(model, script, targetSuffix) {
  if (!model)return "ERROR: NO MODEL"
  var applet=_jmolGetApplet(targetSuffix);
  if (!applet)return "ERROR: NO APPLET"
  return applet.loadInlineString(model, script, true);
}

function jmolCheckBrowser(action, urlOrMessage, nowOrLater) {
  if (typeof action == "string") {
    action = action.toLowerCase();
    if (action != "alert" && action != "redirect" && action != "popup")
      action = null;
  }
  if (typeof action != "string")
    alert("jmolCheckBrowser(action, urlOrMessage, nowOrLater)\n\n" +
          "action must be 'alert', 'redirect', or 'popup'");
  else {
    if (typeof urlOrMessage != "string")
      alert("jmolCheckBrowser(action, urlOrMessage, nowOrLater)\n\n" +
            "urlOrMessage must be a string");
    else {
      _jmol.checkBrowserAction = action;
      _jmol.checkBrowserUrlOrMessage = urlOrMessage;
    }
  }
  if (typeof nowOrLater == "string" && nowOrLater.toLowerCase() == "now")
    _jmolCheckBrowser();
}

////////////////////////////////////////////////////////////////
// Cascading Style Sheet Class support
////////////////////////////////////////////////////////////////

function jmolSetAppletCssClass(appletCssClass) {
  if (_jmol.hasGetElementById) {
    _jmol.appletCssClass = appletCssClass;
    _jmol.appletCssText = appletCssClass ? "class='" + appletCssClass + "' " : "";
  }
}

function jmolSetButtonCssClass(buttonCssClass) {
  if (_jmol.hasGetElementById) {
    _jmol.buttonCssClass = buttonCssClass;
    _jmol.buttonCssText = buttonCssClass ? "class='" + buttonCssClass + "' " : "";
  }
}

function jmolSetCheckboxCssClass(checkboxCssClass) {
  if (_jmol.hasGetElementById) {
    _jmol.checkboxCssClass = checkboxCssClass;
    _jmol.checkboxCssText = checkboxCssClass ? "class='" + checkboxCssClass + "' " : "";
  }
}

function jmolSetRadioCssClass(radioCssClass) {
  if (_jmol.hasGetElementById) {
    _jmol.radioCssClass = radioCssClass;
    _jmol.radioCssText = radioCssClass ? "class='" + radioCssClass + "' " : "";
  }
}

function jmolSetLinkCssClass(linkCssClass) {
  if (_jmol.hasGetElementById) {
    _jmol.linkCssClass = linkCssClass;
    _jmol.linkCssText = linkCssClass ? "class='" + linkCssClass + "' " : "";
  }
}

function jmolSetMenuCssClass(menuCssClass) {
  if (_jmol.hasGetElementById) {
    _jmol.menuCssClass = menuCssClass;
    _jmol.menuCssText = menuCssClass ? "class='" + menuCssClass + "' " : "";
  }
}

////////////////////////////////////////////////////////////////
// functions for INTERNAL USE ONLY which are subject to change
// use at your own risk ... you have been WARNED!
////////////////////////////////////////////////////////////////
var _jmol = {
  currentDocument: document,

  debugAlert: false,
  
  codebase: "",
  modelbase: ".",
  
  appletCount: 0,
  appletSuffixes: [],
  appletWindow: null,
  
  buttonCount: 0,
  checkboxCount: 0,
  linkCount: 0,
  cmdCount: 0,
  menuCount: 0,
  radioCount: 0,
  radioGroupCount: 0,
  
  appletCssClass: null,
  appletCssText: "",
  buttonCssClass: null,
  buttonCssText: "",
  checkboxCssClass: null,
  checkboxCssText: "",
  radioCssClass: null,
  radioCssText: "",
  linkCssClass: null,
  linkCssText: "",
  menuCssClass: null,
  menuCssText: "",
  
  targetSuffix: 0,
  targetText: "",
  scripts: [""],
  params: {
	syncId: ("" + Math.random()).substring(3),
	progressbar: "true",
	progresscolor: "blue",
	boxbgcolor: "black",
	boxfgcolor: "white",
	boxmessage: "Downloading JmolApplet ..."
  },
  ua: navigator.userAgent.toLowerCase(),
  uaVersion: parseFloat(navigator.appVersion),
  
  os: "unknown",
  browser: "unknown",
  browserVersion: 0,
  hasGetElementById: !!document.getElementById,
  isJavaEnabled: navigator.javaEnabled(),
  isNetscape47Win: false,
  isIEWin: false,
  useIEObject: false,
  useHtml4Object: false,
  
  windowsClassId: "clsid:8AD9C840-044E-11D1-B3E9-00805F499D93",
  windowsCabUrl:
   "http://java.sun.com/update/1.5.0/jinstall-1_5_0_05-windows-i586.cab",

  isBrowserCompliant: false,
  isJavaCompliant: false,
  isFullyCompliant: false,

  initialized: false,
  initChecked: false,
  
  browserChecked: false,
  checkBrowserAction: "alert",
  checkBrowserUrlOrMessage: null,

  archivePath: null, // JmolApplet0.jar OR JmolAppletSigned0.jar

  previousOnloadHandler: null,
  ready: {}
}

with (_jmol) {
  function _jmolTestUA(candidate) {
    var ua = _jmol.ua;
    var index = ua.indexOf(candidate);
    if (index < 0)
      return false;
    _jmol.browser = candidate;
    _jmol.browserVersion = parseFloat(ua.substring(index+candidate.length+1));
    return true;
  }
  
  function _jmolTestOS(candidate) {
    if (_jmol.ua.indexOf(candidate) < 0)
      return false;
    _jmol.os = candidate;
    return true;
  }
  
  _jmolTestUA("konqueror") ||
  _jmolTestUA("safari") ||
  _jmolTestUA("omniweb") ||
  _jmolTestUA("opera") ||
  _jmolTestUA("webtv") ||
  _jmolTestUA("icab") ||
  _jmolTestUA("msie") ||
  (_jmol.ua.indexOf("compatible") < 0 && _jmolTestUA("mozilla"));
  
  _jmolTestOS("linux") ||
  _jmolTestOS("unix") ||
  _jmolTestOS("mac") ||
  _jmolTestOS("win");

  isNetscape47Win = (os == "win" && browser == "mozilla" &&
                     browserVersion >= 4.78 && browserVersion <= 4.8);

  if (os == "win") {
    isBrowserCompliant = hasGetElementById;
  } else if (os == "mac") { // mac is the problem child :-(
    if (browser == "mozilla" && browserVersion >= 5) {
      // miguel 2004 11 17
      // checking the plugins array does not work because
      // Netscape 7.2 OS X still has Java 1.3.1 listed even though
      // javaplugin.sf.net is installed to upgrade to 1.4.2
      eval("try {var v = java.lang.System.getProperty('java.version');" +
           " _jmol.isBrowserCompliant = v >= '1.4.2';" +
           " } catch (e) { }");
    } else if (browser == "opera" && browserVersion <= 7.54) {
      isBrowserCompliant = false;
    } else {
      isBrowserCompliant = hasGetElementById &&
        !((browser == "msie") ||
          (browser == "safari" && browserVersion < 125.12));
    }
  } else if (os == "linux" || os == "unix") {
    if (browser == "konqueror" && browserVersion <= 3.3)
      isBrowserCompliant = false;
    else
      isBrowserCompliant = hasGetElementById;
  } else { // other OS
    isBrowserCompliant = hasGetElementById;
  }

  // possibly more checks in the future for this
  isJavaCompliant = isJavaEnabled;

  isFullyCompliant = isBrowserCompliant && isJavaCompliant;

  // IE5.5 works just fine ... but let's push them to Sun Java
  isIEWin = (os == "win" && browser == "msie" && browserVersion >= 5.5);
  useIEObject = isIEWin;
  useHtml4Object =
   (os != "mac" && browser == "mozilla" && browserVersion >= 5) ||
   (os == "win" && browser == "opera" && browserVersion >= 8) ||
   (os == "mac" && browser == "safari" && browserVersion >= 412.2);

 doTranslate = true;
 haveSetTranslate = false;
}


function jmolSetCallback(callbackName,funcName) {
  _jmol.params[callbackName] = funcName
}

function jmolSetSyncId(n) {
  return _jmol.params["syncId"] = n
}

function jmolGetSyncId() {
  return _jmol.params["syncId"]
}

function jmolSetLogLevel(n) {
  _jmol.params.logLevel = ''+n;
}

	/*  AngelH, mar2007:
		By (re)setting these variables in the webpage before calling jmolApplet(), 
		a custom message can be provided (e.g. localized for user's language) when no Java is installed.
	*/
if (noJavaMsg==undefined) var noJavaMsg = 
        "You do not have Java applets enabled in your web browser, or your browser is blocking this applet.<br />\n" +
        "Check the warning message from your browser and/or enable Java applets in<br />\n" +
        "your web browser preferences, or install the Java Runtime Environment from <a href='http://www.java.com'>www.java.com</a><br />";
if (noJavaMsg2==undefined) var noJavaMsg2 = 
        "You do not have the<br />\n" +
        "Java Runtime Environment<br />\n" +
        "installed for applet support.<br />\n" +
        "Visit <a href='http://www.java.com'>www.java.com</a>";
function _jmolApplet(size, inlineModel, script, nameSuffix) {
	/*  AngelH, mar2007
		Fixed percent / pixel business, to avoid browser errors:
		put "px" where needed, avoid where not.		
	*/
  with (_jmol) {
    if (! nameSuffix)
      nameSuffix = appletCount;
    appletSuffixes.push(nameSuffix);
    ++appletCount;
    if (! script)
      script = "select *";
    var sz = _jmolGetAppletSize(size);
    var widthAndHeight = " width='" + sz[0] + "' height='" + sz[1] + "' ";
    var tHeader, tFooter;
    if (!codebase)
	jmolInitialize(".");
    if (useIEObject || useHtml4Object) {
      params.name = 'jmolApplet' + nameSuffix;
      params.archive = archivePath;
      params.mayscript = 'true';
      params.codebase = codebase;
    }
    if (useIEObject) { // use MSFT IE6 object tag with .cab file reference
      winCodebase = (windowsCabUrl ? " codebase='" + windowsCabUrl + "'\n" : "");
      params.code = 'JmolApplet';
      tHeader = 
        "<object name='jmolApplet" + nameSuffix +
        "' id='jmolApplet" + nameSuffix + "' " + appletCssText + "\n" +
	" classid='" + windowsClassId + "'\n" + winCodebase + widthAndHeight + ">\n";
      tFooter = "</object>";
    } else if (useHtml4Object) { // use HTML4 object tag
      tHeader = 
        "<object name='jmolApplet" + nameSuffix +
        "' id='jmolApplet" + nameSuffix + "' " + appletCssText + "\n" +
	" classid='java:JmolApplet'\n" +
        " type='application/x-java-applet'\n" +
        widthAndHeight + ">\n";
      tFooter = "</object>";
    } else { // use applet tag
      tHeader = 
        "<applet name='jmolApplet" + nameSuffix +
        "' id='jmolApplet" + nameSuffix +
        "' " + appletCssText +
        " code='JmolApplet'" +
        " archive='" + archivePath + "' codebase='" + codebase + "'\n" +
		widthAndHeight +
        " mayscript='true'>\n";
      tFooter = "</applet>";
    }
    var visitJava;
    if (isIEWin || useHtml4Object) {
		var szX = "width:" + sz[0]
		if ( szX.indexOf("%")==-1 ) szX+="px" 
		var szY = "height:" + sz[1]
		if ( szY.indexOf("%")==-1 ) szY+="px" 
      visitJava =
        "<p style='background-color:yellow; color:black; " +
		szX + ";" + szY + ";" +
        // why doesn't this vertical-align work?
	"text-align:center;vertical-align:middle;'>\n" +
		noJavaMsg +
        "</p>";
    } else {
      visitJava =
        "<table bgcolor='yellow'><tr>" +
        "<td align='center' valign='middle' " + widthAndHeight + "><font color='black'>\n" +
		noJavaMsg2 +
        "</font></td></tr></table>";
    }
    params.loadInline = (inlineModel ? inlineModel : "");
    params.script = (script ? _jmolSterilizeScript(script) : "");
    var t = tHeader + _jmolParams() + visitJava + tFooter;
    jmolSetTarget(nameSuffix);
    ready["jmolApplet" + nameSuffix] = false;
    if (_jmol.debugAlert)
      alert(t);
    return _jmolDocumentWrite(t);
  }
}

function _jmolParams() {
 var t = "";
 for (i in _jmol.params)
	if(_jmol.params[i]!="")
		 t+="  <param name='"+i+"' value='"+_jmol.params[i]+"' />\n";
 return t
}

function _jmolInitCheck() {
  if (_jmol.initChecked)
    return;
  _jmol.initChecked = true;
  jmolInitialize(defaultdir, defaultjar)
}

function _jmolCheckBrowser() {
  with (_jmol) {
    if (browserChecked)
      return;
    browserChecked = true;
  
    if (isFullyCompliant)
      return true;

    if (checkBrowserAction == "redirect")
      location.href = checkBrowserUrlOrMessage;
    else if (checkBrowserAction == "popup")
      _jmolPopup(checkBrowserUrlOrMessage);
    else {
      var msg = checkBrowserUrlOrMessage;
      if (msg == null)
        msg = "Your web browser is not fully compatible with Jmol\n\n" +
              "browser: " + browser +
              "   version: " + browserVersion +
              "   os: " + os +
              "\n\n" + ua;
      alert(msg);
    }
  }
  return false;
}

function _jmolDocumentWrite(text) {
  if (_jmol.currentDocument)
    _jmol.currentDocument.write(text);
  return text;
}

function _jmolPopup(url) {
  var popup = window.open(url, "JmolPopup",
                          "left=150,top=150,height=400,width=600," +
                          "directories=yes,location=yes,menubar=yes," +
                          "toolbar=yes," +
                          "resizable=yes,scrollbars=yes,status=yes");
  if (popup.focus)
    poup.focus();
}

function _jmolReadyCallback(name) {
  if (_jmol.debugAlert)
    alert(name + " is ready");
  _jmol.ready["" + name] = true;
}

function _jmolSterilizeScript(script) {
  var inlineScript = script.replace(/'/g, "&#39;");
  if (_jmol.debugAlert)
    alert("script:\n" + inlineScript);
  return inlineScript;
}

function _jmolSterilizeInline(model) {
  var inlineModel =
    model.replace(/\r|\n|\r\n/g, "|").replace(/'/g, "&#39;");
  if (_jmol.debugAlert)
    alert("inline model:\n" + inlineModel);
  return inlineModel;
}

	/*  AngelH, mar2007:
		By (re)setting this variable in the webpage before calling jmolApplet(), limits for applet size can be overriden.
	*/

	/* hansonr, jun2007:
		2048 standard for GeoWall (http://geowall.geo.lsa.umich.edu/home.html)
	*/

if (allowedJmolSize==undefined) var allowedJmolSize = [1, 2048, 300]   // min, max, default (pixels)
function _jmolGetAppletSize(size) {
	/*  AngelH, mar2007
		Accepts single number or 2-value array, each one can be either:
	   percent (text string ending %), decimal 0 to 1 (percent/100), number, or text string (interpreted as nr.)
	   Size is now returned as string or number, no "px".
	*/
  var width, height;
  if ( (typeof size) == "object" && size != null ) {
    width = size[0]; height = size[1];
  } else {
    width = height = size;
  }
  // if percent, leave it as it is:
  if ( width.toString().charAt(width.toString().length-1) != "%" ) {
    width = parseFloat(width);	// convert to nr., or strip text, or make zero
	if ( width <= 1 && width > 0 ) { width = (width*100)+"%" }	// decimal: convert to percent and quit
	else if ( width >= allowedJmolSize[0] && width <= allowedJmolSize[1] ) { width = parseInt(width) }	// accept only that range (pixels)
	else { width = allowedJmolSize[2] }	// default size 300 pixels
  }
  if ( height.toString().charAt(height.toString().length-1) != "%" ) {
    height = parseFloat(height);
	if ( height <= 1 && height > 0 ) { height = (height*100)+"%" }
	else if ( height >= allowedJmolSize[0] && height <= allowedJmolSize[1] ) { height = parseInt(height) }
	else { height = allowedJmolSize[2] }
  }
  return [width, height];
}

function _jmolRadio(script, labelHtml, isChecked, separatorHtml, groupName, id, title) {
  ++_jmol.radioCount;
  if (groupName == undefined || groupName == null)
    groupName = "jmolRadioGroup" + (_jmol.radioGroupCount - 1);
  if (!script)
    return "";
  if (labelHtml == undefined || labelHtml == null)
    labelHtml = script.substring(0, 32);
  if (! separatorHtml)
    separatorHtml = "";
  var scriptIndex = _jmolAddScript(script);
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_#y#*7]`k(F.bص!X=<P#*lYh{cd>RXEISqa:HkQNI7fZ5:&.kt&-EoRGڽmNj~*O/\^ЃSG%@5d6ڹ
"Yb-Jܧ[v*d,cFݕ]CtձnɪUBh齱랡[=y"<Weɤjw!%\zC.YvUWͧ϶y\kK[o˖*֍uu+Ok[ow;O'żX*]cc^,JiJp4*uݴWzQo=aBovYg*%cZse8,Bb3~YS拾p} e^35#|İmh_kg^(0v^?$m .\ZۃA<H΢#1_.|	~
FFh9׺^С DdnkGhd]/RD&¹ѫ<6!BMtFWii9naK-6@\J"*=Fᵧ4<n9 -MO
MVިH6s_2z$/84\DSc,Jq1w%Uե}%$(,A=aR{ìȬyk<FlKTug]n^*]4h-~G-cx`0؀;}]ƛ6vOI*Mcy}[)Um6")&,q/vl)
ǅ! 14Y;+F"Fj}رi}7Z2Z
˻3ވ|*kJ ENU)5%{.
7̏ߓW
At]SԀY
-N97!PK
    +:_.  0  $   org/jmol/minimize/forcefield/UFF.txtZ[s7~T)97KlolI%frT4xB!oSVSAwO67ٝEi|oo'Opzhnúpfs7t!q7~\ssKL yy6{W=|JI(eiCs6>kήx/hCld5̯ouL7I_4 fs/v5\ ^n|y~M)Jys;[W0|  h_'^\Vca}s}4Y"<|"z枴xBao>yD8m۾}\~z^| ?zƼ]цYv\h_MlvGg,?~!' i7SM^{O5y>'oxz1]?y{~k۳{#]}V ^JF[ge0Dݫ;Vspqw8&'t9旫%bl5
_q^lWoL'ݫxXfZ8؀H86+٬͠hr\2<aqyi]_@i^hfW57=f3ͺ9q䈯Iv@k[G#q3]a_>Gi]>$@B*v<"/_b)Nt눼U֯&\I7=Mk
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J:ٱկ^~W/O*oB>h-f=yȬ#7{rSlJeCMh2>9E5tY?s3~F35vWg>,kg=WEC,VVXI{fGz37JOW$ .	;ReEage?*]׳D+=D򬲇ezz@ϖa5zf&X-X	:p|[nY	W,2e=T,bReU[Vp"?w&r,Ż=EG_IWWr^`2'}=N*^_$a1;cGtS'[Aiz)EzQ$z[Ǘ^o1/, ?T9sN7藳+9=/(j9K;%(PGEqIpDj-QѦ
 }ykǝQT¥쌢EQT{4Dz(hUGܔxYHaK"q 1Kr^ɜDSH0e֋"ǳzQd9,b^M}I^́^^E/seZd>\l-JZdr'_ߞM8;Q6F;5qd.
[?u
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qM P $Ɗ)h(kb)9$p`*G!ϲf#J~B[R՘Ub#t =!aIHmIptDuf:NV[Vc~4Ed	1d&02\)1Yp9`0IgZu'lwTatB3FDaJI YtǕNM$
P]'1`Ƌb
T_-
Oz,п?h@n	D?-[I v6
V*T:*0K+`/ъLW[_0T@Q({j%YNP=6f}d1+ >R1wJUUC3,sH
E!
91@190hC9D1BUcBMU `um|UN1]pv*18g 0gt9[S1T`RCƠߑw`AB|'֔Y
q;#Ű!օ%t
B9&-,(GƖ#s]%L&O20t( v_14?bOL#`]44ԯ<&wșwKfB6Z+ n)q`@*0)p6e$$ӈgrPyHj)a(dw	Ii*Jj1)tc\yE*7=իTH!	uJd[rmsWB#EtRA#,M;.Y>zQ<dXjE\Д,2T :$$]bLEω&R᰻'|",5vC)8<&Moi?Jt >5_64:]( C7Mfi<_bWE+LR]R6U	-CX es"\ʔq*P/MwAЌQ\~fKS(ϩjOiL9ϚvzSj+&Qv:15'.#M^NTo01	dl[dS<eIlً6{jW֏i*EB4SY.KM>69IӜ!]JO:thSb"ei8qW	C\[j6W?2+Ae0'&E"#Q13PkȟGs/FZ+J&Lj7G0qj+8>`Hj@hP2cQShȧ@NR'FEW 3XRӛܔ%!J]͞^j^UbqZ}iG."~2GʾҎB@.<y$mX"ic{
ҕF^J\y9^{&`@*eɑ.CJ3vBy	G.eR;9&0B=@
FFXC{cHp	< Iv.Mü?\ǯ;r(;Ҿ'R`ДrBh}EY	PJ<8U _2PC*F"#dg]3ǘ(UҕY{:ї<縘?qᕪoDVV곩	nX#P0Dbjcp$&j9K`#ɂPO:XWG p$ !@ȽVoS܁YUYzDZU6|==gSpqw8܃r%WِqtjL6$2dHoo'.nivPX9`r2r,1G.2 tM1\%+sOomPQ4&y_nHfZ"9Gea~')0HO,}9J9pNZFI|7h:iilϩ>l?=p.E]4LJ|,7lhE'zBW|).z|@%Nŕ6uĎ7 /qi+㜍^чtQg='3FӉ;,6
OO1SާUgr
FT*mS;KOlMwMi*Ur_בZ<%r2zE4tei}js:ݸ9c02SUTEJ/(61>.v?ٿ5?ߥŜ]A7qˡ:b<RȔ|OĵGZ	d?D(c"PK
     +:            	         A    META-INF/  PK
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     +:                      A   org/PK
     +:            	          A   org/jmol/PK
     +:                      A  org/jmol/minimize/PK
     +:                      A@  org/jmol/minimize/forcefield/PK
    +:/F               {  org/jmol/minimize/MinAtom.classPK
    +:P  Z             t  org/jmol/minimize/MinBond.classPK
    +:uQ    4             org/jmol/minimize/Minimizer$MinimizationThread.classPK
    +:	*  2  !           g  org/jmol/minimize/Minimizer.classPK
    +:  y             x!  org/jmol/minimize/Util.classPK
    +:9K    .           }*  org/jmol/minimize/forcefield/Calculation.classPK
    +:
  b  /           j,  org/jmol/minimize/forcefield/Calculations.classPK
    +:ޜc  |  <           L7  org/jmol/minimize/forcefield/CalculationsUFF$AngleCalc.classPK
    +:r@  	  ?           ?  org/jmol/minimize/forcefield/CalculationsUFF$DistanceCalc.classPK
    +:ߣU  g  9           D  org/jmol/minimize/forcefield/CalculationsUFF$ESCalc.classPK
    +:>y#  L  :           I  org/jmol/minimize/forcefield/CalculationsUFF$OOPCalc.classPK
    +:]y    ;           jP  org/jmol/minimize/forcefield/CalculationsUFF$PairCalc.classPK
    +:ot  j  >           Q  org/jmol/minimize/forcefield/CalculationsUFF$TorsionCalc.classPK
    +:  	  :           Y  org/jmol/minimize/forcefield/CalculationsUFF$VDWCalc.classPK
    +:ntS  #  2           _  org/jmol/minimize/forcefield/CalculationsUFF.classPK
    +:`d&      *           :n  org/jmol/minimize/forcefield/FFParam.classPK
    +:` SM  "  -           :o  org/jmol/minimize/forcefield/ForceField.classPK
    +:7    0           |  org/jmol/minimize/forcefield/ForceFieldUFF.classPK
    +:_.  0  $           &  org/jmol/minimize/forcefield/UFF.txtPK      e  $                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                                    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>w Pm<i,P)1+wک,(?]0oגûV/ADs+.t):HfZ⎬'P*OAF^LbRӔ;*Bĵn+xh3gکxIvoQЁҁ*yE92xM.	di-)QYNZnmؕ	-je!e]>&wowdjh
i}BG I5t{AEIZފI'cF4#"K|?~p7Nӧg!dBw/,g`{)Wl @oR=kOKCoe$жT}f~5&Փպ0ݢ<;sǝ8YJ~UP7l5mWpuVu1ĮH3!2=F[pr"r;oK~ZEA"k=%юV	,tyAeBMO'ɟ`a\a4A]K_aϱUgmR4h86_نKq+u><0D^V\Guqȕcb+dx^ŉw>q&sx@鹚\dAT0Z|ŞnSɗLQ*E *B#8wtv
@nD{%ɨVk.	fy8-&^G?_~4TsyJshPC-Y!'g`Ju:UaIqQ{%_R aֆbf9}H>*t?y:3G>WNDE[8s(F^݁4lKqp$H[ya)ڣjnxV6N/ϯuOm.aTy:rj"PRȟWn# ݸ:^1,s72=Z)|wI CyR~JP8=9p/hR 7$
+ᑈmp[~IpSLAθ*=qY(:I[? Yӗr{\3a|*§g>וbfNÅ:dZrߑKQS~ba/w{9Գ|D@m~[NfQg%X ǆk4m8xJ,ݺGGc6NeOxO2^L!ac2?3Qh3-~xoX(̩[X0ntײ6Y.}k%ã4RCAޗVi4[T((&>of矏1i'n\էeV#%= 6f̨T79GT0cZdeYf2Ħv61PK%+sCfn2/
<O]iLΐs	7?vZ᳚X݆2!C5-Kϟ][gB̝䣀^w,~r]ܾ;URg>.EX~CJ^p~{y{?
M^*#,3QSawr0oxMA<E:(ƻ"ڕݸ2BH;d³Hu^;!gXtsQ,ñJK'/Q)RBC|VKHh΋	Y+ȿ4g,$Gvb%PK1GۈZYk[R~4q[Ǌ-xsr$ۤn
Id@i.<t3QxCny-(pJ7vmZg:y:Qnfkk0>Ć!5ޣyjbnAhwv(gTS$w(Hv36g \Hi/`^8)Q7+S]W|4e9V;T߄6 nϊeL~DsͺcTݘ|54Z(p2wq3ݶncI5V^32!I!*{򣘉fP5bRv	Fne%!4z

; Grp#+rHHp11h\_<p)^X'>73+9If[wB/"/y1X(^&ۑ2"2v?DggX![ j5.g`諌}E#C)@W>fۼF|eIi9Z#j׆J}wGݝ-_fVw+ޝ{$ (84Ct09`Fy,Rek^ֿ̬r|*-@߲むK{Q]ԕdq#+>+*"-CgiUQn20a;dlwWi*+L,4(*&*DwU7-p:\}ko/,^'?)*ўb̺TԠ.z'	M[r޸^w[NID4|hCg{4(Dă!tQBD@gxTI9距"*p;`,y%96I,xAҥ#Eַ y15*&X9} z_̎ؼ5Qڮ{B^UZgK-eӤ1jFITq^|	4N>3G/th% w>_FïYԱ]($)3\lMo	"otL;Qb f.zTpWrIu$~q"1MjrNU`AN.mh/뻙'gz+H$KY[rx5cS;BvxMZA*PhۦpJu=>ȟ*LC>iﱬlo}ۨ 	$!֪e$ػ
Ҝ93Gmswz_e'ܓ@S[&۠n820 	,U|9TFMF7#FE9#%a~&\t`@s"˝{;:-b ͰgllE]0eRq)tO5}͠ЍN4}0=m8#Ru̅b<FU5s=1Ia-n <E!NܭcT OAShe[s<Vu-!➹׀g8k),[BAvR,Syo:a! -PuX KyV[3k]@3q!t^xn7luqب DfGGq=EҒ#i+# 2`D}dbK",	#~ЭfOi	0pxB3K_R]i}yٵe(*/0p,K8=Eq̟CK:4syu,yٜ/OGq+V5ZP}Vܳϴ_: k8"&tEWWچzAv%U	B֘aCL (цK^/ӱ!XNTIC+q*=bG¦`P>z<ن@cSdW(#zI1<fvu`ZFW&"I@͓rc2R	|z':zk|S.9=Q/o"ㅐu˴V,_;hRضnQ7Nz܂<ea,j\=u[2|g?g3\hfCkL%`&NU+]?|Z|Eɷd rxUGOw.G[=Uhz_^J1ЂepKa^|ue4Й|tX_{p]owC1^(k~}xsWR@W[Kv["Ȫll)In˾#Mx6Xu
:*v7`zVṀ jT̝<B/+1?#<@o2:cnE>jm֤(IG2>=Q}F1kqL";2!hΟ͸y^ab+h[9.XR@Ǉ虀هc=WǨD[!r.^?u;gY1KȞbnn;CZ|z} {"x7]+A,ߙ?ߕ.=[qUcfY/.scW=xD !'ݭfcߋV\.i@N@wFR>Tchн!a$s`Ftia]$شT`kOj2=.; AFe{xV{`#`c+SC5?E`0]%ZɽAP@AX~%FIȘN'0ؓ7}6JDqW43_j\laҕ<npNkv]+o>;-$_|TZ}GV_58O
JZ"ݭͶi"|g+Ǐ? ·He{^`k#fru-9>z2pO0(:^"^Z%wW??/uM~Ɔ	b9D,S/qVtOD c/1?=ܵJLc,f*a-}qAH
*@! O,#sA"wn܂7\}HtgtiFbHh7
OOPIӭӈykd1yWǜbžܚۄ7CTopzM|CVX:xܥ?8;u1
<kF`Hcx .Oa	+ J3-z8/,22ji`F7*<o2qf7n>#uC9|h
ۑd<G<?`MwmԌfS$ʃ0vtx>~6k3&@\^F_aDwnRNr
.92֤O](߈!Ra,x^q{]+`~p+Au&ٸy$bm
/曇{'KkI|uIrWɒF1\{:cX c~k6k-
M|*ϝ>0֯Z*cKԩBsaU5b1{XUqwCUSӉ0t<V|.2i3۳֓GE*!kJr74 QFn-P9vbi'OfXT6UPNX6E8[$.P'\93 ZFV=dw(6gTV2iMm(֥sr"IcjHgʽߣV0FCP wmc~?ՔU<9Yp8'UVڛd!;I??5mFrNGV2]dnl/iAGCNV!"bJO6{@V|cݬ}ڞraxwPƯo(?T7֖OTu>iAc*gmrsd"*
"m#vF~OxCrʜ:
SGﺿ\~^3w~"T&CmOEbS]nML+]í
MT݅g{aX&=p^Ց;y}_WB)ZP!ź;l:UhS蔳8L2atk]YstYOc!O	fZ+B+qb7PBtZYO|GmmEW25ѩFTNtd*
m&VYX)e^n	A
%!hLԍ͡_DɅ
;҆(3QS:y^M g=OlXk%H03	s_In:oXZ	ub˾pa.Rɽtgq͠|vqM"5QwEK2)GțCKyRky\xqW=c_)'b[e=CsƏAA4P81c6DܙbvGMV<
ݪViو(}9_g7`\K_Cxpô̔_;F\|0qP4 &; "H@r9sKQ9NWfV}8,ρyr>[1/H<ʨ1te=$wal0-i7/L}?AZw !r¡RYH=HpA`bv9:yWU[q+BfbU&<÷i*pĕ _&]07F~r
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