loadScript ../packages/jsmol/j2s/core/package.js
loadScript ../packages/jsmol/j2s/core/corejmol.z.js
loadScript ../packages/jsmol/j2s/J/translation/PO.js
loadScript ../packages/jsmol/j2s/core/corescript.z.js
JSmol exec MoleculeDisplay load JSExporter J.export.JSExporter
loadScript ../packages/jsmol/j2s/J/export/JSExporter.js
loadScript ../packages/jsmol/j2s/J/export/___Exporter.js
loadScript ../packages/jsmol/j2s/J/export/Export3D.js
loadScript ../packages/jsmol/j2s/J/export/__CartesianExporter.js
loadScript ../packages/jsmol/j2s/J/g3d/HermiteRenderer.js
loadScript ../packages/jsmol/j2s/J/export/UseTable.js
JSmol exec MoleculeDisplay start applet null
Jmol JavaScript applet MoleculeDisplay__09044876256801__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__09044876256801__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C595904&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__09044876256801__","codePath":"https://webbook.nist.gov/cgi/../packages/jsmol/j2s/","signedApplet":"true","appletReadyCallback":"Jmol._readyCallback","statusListener":"[J.appletjs.Jmol object]","script":";set multipleBondSpacing 0.35;","syncId":"09044876256801","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C595904&Type=JSmol"
(C) 2015 Jmol Development
Jmol Version: 14.29.53 2019-08-18 15:32
java.vendor: Java2Script (WebGL)
java.version: 2019-06-08 00:17:46 (JSmol/j2s)
os.name: Mozilla/5.0 AppleWebKit/537.36 (KHTML, like Gecko; compatible; ClaudeBot/1.0; +claudebot@anthropic.com)
Access: ALL
memory: 0.0/0.0
processors available: 1
useCommandThread: false
appletId:MoleculeDisplay (signed)
Jmol getValue emulate null
defaults = "Jmol"
Jmol getValue boxbgcolor null
Jmol getValue bgcolor black
backgroundColor = "black"
Jmol getValue ANIMFRAMECallback null
Jmol getValue APPLETREADYCallback Jmol._readyCallback
APPLETREADYCallback = "Jmol._readyCallback"
StatusManager callback set for APPLETREADYCallback f=Jmol._readyCallback cb=APPLETREADY
Jmol getValue ATOMMOVEDCallback null
Jmol getValue AUDIOCallback null
Jmol getValue CLICKCallback null
Jmol getValue DRAGDROPCallback null
Jmol getValue ECHOCallback null
Jmol getValue ERRORCallback null
Jmol getValue EVALCallback null
Jmol getValue HOVERCallback null
Jmol getValue IMAGECallback null
Jmol getValue LOADSTRUCTCallback null
Jmol getValue MEASURECallback null
Jmol getValue MESSAGECallback null
Jmol getValue MINIMIZATIONCallback null
Jmol getValue SERVICECallback null
Jmol getValue PICKCallback null
Jmol getValue RESIZECallback null
Jmol getValue SCRIPTCallback null
Jmol getValue SYNCCallback null
Jmol getValue STRUCTUREMODIFIEDCallback null
Jmol getValue doTranslate null
language=en_US
Jmol getValue popupMenu null
Jmol getValue script ;set multipleBondSpacing 0.35;
Jmol getValue loadInline null
Jmol getValue load null
script 1 started
multipleBondSpacing = 0.35
Script completed
Jmol script terminated
loadScript ../packages/jsmol/j2s/core/coreprop.z.js
loadScript ../packages/jsmol/j2s/JU/XmlUtil.js
Jmol applet MoleculeDisplay__09044876256801__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C595904)
FileManager opening url https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C595904
The Resolver thinks Mol
NIST 07021513063D 1 1.00000 -929.95792
Copyright by the U.S. Sec. Commerce on behalf of U.S.A. All rights reserved.
copyright:"Collection (C) 2016 copyright by the U.S. Secretary of Commerce on behalf of the United States of America. All rights reserved."
date:"2015-07-02"
cas.number:"595-90-4"
method:"B3LYP/GENECP"
dipole.moment:"0.0059 debye"
electronic.energy:"-929.957918673 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n22.5826 0.0114\n25.3997 0.0044\n29.0689 0.0006\n29.2286 0.0016\n32.4251 0.0026\n36.6584 0.0650\n37.6698 0.0560\n39.2800 0.0407\n41.8293 0.0342\n137.3843 0.0195\n145.1288 2.5784\n145.7602 2.5484\n185.3159 3.0937\n196.2166 0.0008\n206.2367 2.7925\n206.8410 2.7805\n214.7102 0.0030\n220.3587 0.0795\n267.7012 43.0684\n268.1770 43.2815\n275.8128 48.4321\n404.2123 0.1070\n405.0378 0.0801\n405.9235 0.0213\n408.3935 0.1153\n455.5223 0.2676\n461.2637 26.7723\n461.5444 26.8215\n469.9382 15.4958\n632.7841 0.0005\n632.9528 0.0375\n633.0159 0.0390\n633.3991 0.0483\n662.6440 0.0025\n668.4972 1.2400\n668.6555 1.9946\n668.9970 1.9656\n717.2037 28.4468\n717.5734 30.0282\n718.0447 23.7509\n719.2232 1.8830\n746.6024 8.7391\n746.8663 23.6067\n747.0334 21.0555\n749.1223 17.6936\n871.8829 0.0756\n872.5476 0.0773\n873.1358 0.0219\n875.5179 0.0361\n928.8433 0.2292\n929.1947 0.2729\n929.5193 0.0372\n931.1029 0.0157\n977.1061 0.0614\n977.4831 0.0497\n977.7514 0.0862\n979.5460 0.0796\n1003.2125 0.0439\n1003.2681 0.0168\n1003.4611 0.0270\n1003.8965 0.0019\n1014.7645 6.2012\n1014.9396 4.7648\n1014.9896 4.8428\n1016.0048 0.0325\n1044.0623 0.0002\n1045.4283 0.0458\n1045.5175 0.0621\n1045.5771 0.0577\n1097.4822 2.8153\n1098.4641 15.7174\n1098.5190 17.7247\n1099.2035 16.2931\n1102.7845 0.2284\n1103.1559 0.5876\n1103.7129 0.4791\n1105.1429 0.1160\n1194.4664 0.1869\n1194.5791 0.1202\n1194.6879 0.0858\n1194.7217 0.0233\n1224.3826 5.2559\n1224.7611 4.7200\n1225.2443 5.2263\n1226.5517 0.3512\n1322.2082 4.2506\n1322.5315 4.2411\n1324.2369 4.5734\n1324.6290 2.4514\n1369.7188 1.1179\n1369.9080 0.2853\n1370.4865 1.0457\n1371.6050 0.8163\n1474.7990 15.3724\n1475.0097 15.7192\n1475.9126 0.4200\n1477.1424 25.3311\n1530.4087 0.0618\n1531.2269 2.4819\n1531.3353 3.6154\n1531.6664 3.4604\n1628.6543 0.1779\n1628.7509 0.2377\n1629.0241 0.0481\n1629.8431 0.8303\n1641.6232 0.3123\n1641.7809 0.2595\n1641.8576 0.2580\n1642.2735 0.0009\n3167.5496 7.8078\n3167.6262 7.2871\n3168.0474 0.9479\n3168.4858 0.0818\n3171.1298 1.9063\n3171.4252 3.2076\n3171.9620 2.1773\n3172.6261 2.8165\n3182.2829 1.5353\n3182.5209 1.6143\n3182.7418 1.4767\n3183.2118 0.3209\n3191.7450 28.4076\n3191.8207 42.7448\n3191.8918 30.0886\n3192.1048 66.4374\n3203.7954 55.1288\n3203.9323 55.4710\n3203.9890 55.6592\n3204.5262 1.1398"
rotational.constants:"0.16348 GHz\n0.15970 GHz\n0.15920 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Daniel Graham"
Time for openFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C595904): 57 ms
reading 45 atoms
ModelSet: haveSymmetry:false haveUnitcells:false haveFractionalCoord:false
1 model in this collection. Use getProperty "modelInfo" or getProperty "auxiliaryInfo" to inspect them.
Default Van der Waals type for model set to Babel
45 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 11 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10