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__38213138291353__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__38213138291353__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C53833855&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__38213138291353__","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":"38213138291353","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C53833855&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__38213138291353__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C53833855)
FileManager opening url https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C53833855
The Resolver thinks Mol
NIST 08031214523D 1 1.00000 -618.52890
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:"2012-08-03"
cas.number:"53833-85-5"
method:"B3LYP/6-31G*"
dipole.moment:"4.3676 debye"
electronic.energy:"-618.528896105 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n43.1149 0.5007\n52.2198 3.3129\n56.4841 1.6345\n90.6282 0.6971\n118.1774 1.4652\n167.5809 0.9242\n172.2356 0.0483\n188.6422 0.3244\n197.2638 0.8785\n218.1579 0.3458\n236.7698 0.0702\n254.6572 0.3902\n280.3666 1.3028\n324.3389 0.2778\n344.6172 1.7010\n370.1554 1.7374\n408.0971 3.9827\n432.4701 0.9093\n465.8659 0.0545\n510.8133 2.4725\n561.6999 4.8371\n570.7261 5.6325\n611.0816 2.6434\n627.0373 16.1359\n670.0999 6.5403\n792.0806 0.6130\n808.0291 12.6760\n832.4298 0.6072\n854.5207 9.8450\n890.0029 1.2038\n919.3257 2.2488\n937.3103 2.4627\n940.3422 2.9774\n972.1692 0.4726\n979.6521 0.7855\n992.5652 5.1338\n1013.8413 29.9844\n1029.6252 16.6693\n1042.1721 157.5879\n1055.0227 7.0144\n1068.1739 7.5574\n1073.4556 5.2441\n1082.0332 6.1963\n1098.7862 1.6185\n1131.6621 6.1569\n1150.2818 15.9581\n1180.7541 6.3133\n1194.8948 2.3448\n1246.9582 15.3926\n1260.1814 132.0117\n1271.3715 363.5105\n1307.3350 23.8864\n1344.5285 9.8342\n1375.1592 2.1680\n1385.9881 25.5544\n1395.4056 2.4929\n1410.2487 2.6242\n1420.2244 63.6731\n1427.2895 9.5658\n1441.7372 2.7851\n1447.2733 5.0546\n1500.3874 7.6149\n1507.5702 0.8588\n1507.7877 9.2860\n1516.2998 11.6645\n1516.8955 6.0753\n1517.7645 2.2631\n1524.1754 4.0217\n1537.6772 4.3109\n1540.3222 8.4315\n1714.5925 19.3509\n1844.6167 363.0283\n3036.5553 28.7325\n3041.4216 24.4257\n3047.5624 21.4654\n3062.9787 3.6807\n3072.9003 0.7259\n3076.6993 28.6907\n3084.2846 15.8904\n3104.3387 2.1658\n3113.6181 59.7752\n3115.2751 36.2944\n3121.1555 32.9450\n3127.2292 7.6866\n3128.2531 20.0683\n3134.7656 23.0507\n3181.1066 10.7292\n3184.7479 14.6071\n3203.7757 14.3753\n3216.5615 14.5950"
rotational.constants:"0.79498 GHz\n0.57894 GHz\n0.39158 GHz"
software:"Gaussian 09, Revision C.01"
contributor:"Jeffrey Qiu"
Time for openFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C53833855): 305 ms
reading 32 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
32 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 8 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10