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__729144804078024__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__729144804078024__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/inchi?Str3View=C776885&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__729144804078024__","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":"729144804078024","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/inchi?Str3View=C776885&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__729144804078024__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/inchi?Str3File=C776885)
FileManager opening url https://webbook.nist.gov/cgi/inchi?Str3File=C776885
The Resolver thinks Mol
NIST 07071507513D 1 1.00000 -617.34962
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:"2015-07-07"
cas.number:"776-88-5"
method:"B3LYP/6-31G*"
dipole.moment:"1.8327 debye"
electronic.energy:"-617.349618852 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n59.9195 0.0370\n62.5458 0.5658\n119.2581 0.0866\n155.2671 0.0084\n213.9068 0.0692\n220.8828 2.7713\n232.5888 0.1806\n251.7570 0.7509\n288.9780 0.1111\n346.4369 1.6417\n371.1698 11.0625\n401.3040 0.0349\n416.9592 1.2719\n422.6344 0.0134\n470.5148 4.9997\n473.5400 2.0179\n508.9983 4.7823\n523.0657 1.3943\n632.7612 10.8291\n633.2469 0.1527\n706.7230 2.7626\n719.9457 16.4249\n752.6603 41.6413\n792.2171 6.3590\n875.0887 0.3217\n883.6772 11.7807\n914.5660 0.0051\n936.5855 10.3079\n951.1851 14.4850\n952.4533 14.4238\n962.8989 7.2006\n965.6456 7.2979\n985.0865 2.6075\n987.2503 12.5468\n1003.7046 3.1563\n1018.8687 0.6610\n1053.4554 58.0594\n1057.3440 6.3484\n1064.3970 19.0038\n1082.7323 0.1568\n1113.0445 1.1262\n1144.2941 230.8993\n1191.8761 0.0204\n1204.9551 42.8273\n1220.9881 23.7581\n1228.6591 81.4719\n1254.2669 2.2662\n1271.2836 4.0904\n1317.8055 0.5782\n1337.9372 0.3546\n1354.5583 2.5377\n1360.5180 0.6962\n1371.4224 62.8825\n1388.3768 0.5951\n1417.0286 4.0541\n1422.8544 7.8005\n1431.7278 1.9255\n1457.3882 12.7097\n1495.5443 9.9360\n1515.2473 2.0888\n1518.7317 0.0233\n1521.9650 1.9409\n1533.6769 2.8354\n1539.4890 6.3950\n1540.3184 5.1070\n1541.5004 12.4109\n1643.2344 0.0946\n1662.7485 0.2244\n3013.4451 15.0136\n3020.1921 55.1898\n3039.0786 33.6409\n3047.2678 27.8120\n3085.0229 31.9949\n3098.6330 6.7657\n3101.1706 3.9625\n3102.7516 9.2486\n3107.5802 69.3308\n3108.4347 74.8769\n3148.0672 14.8048\n3180.7167 0.1772\n3190.2148 14.2302\n3202.7150 28.1770\n3212.0138 18.1194\n3214.8706 5.4140"
rotational.constants:"1.50435 GHz\n0.42681 GHz\n0.41503 GHz"
software:"Gaussian 09, Revision D.01"
contributor:"Ashley Zhang"
Time for openFile(https://webbook.nist.gov/cgi/inchi?Str3File=C776885): 152 ms
reading 30 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
30 atoms created
ModelSet: not autobonding; use forceAutobond=true to force automatic bond creation
Time for creating model: 15 ms
Script completed
Jmol script terminated
__Exporter exportScale: 10
__Exporter exportScale: 10