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__9302112476594315__ initializing
Jmol getValue debug null
Jmol getValue logLevel null
Jmol getValue allowjavascript null
AppletRegistry.checkIn(MoleculeDisplay__9302112476594315__)
vwrOptions:
{ "name":"MoleculeDisplay","applet":true,"documentBase":"https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C1076477&Type=JSmol","platform":"J.awtjs.Platform","fullName":"MoleculeDisplay__9302112476594315__","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":"9302112476594315","bgcolor":"black" }
setting document base to "https://webbook.nist.gov/cgi/cbook.cgi?Str3View=C1076477&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__9302112476594315__ ready
script 2 started
FileManager.getAtomSetCollectionFromFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C1076477)
FileManager opening url https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C1076477
The Resolver thinks Mol
NIST 06181211503D 1 1.00000 -538.75649
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:"2012-06-18"
cas.number:"1076-47-7"
method:"B3LYP/6-31G*"
dipole.moment:"5.3871 debye"
electronic.energy:"-538.756489858 hartree"
ir.frequencies:"\"Frequency (cm-1)\" \"Intensity (km/mol)\"\n63.3476 4.6724\n89.1517 2.6013\n112.9207 0.2598\n136.7457 0.1209\n176.6192 1.4485\n196.4769 1.0216\n224.1824 2.9210\n258.5409 3.3034\n288.4787 7.2540\n327.6757 1.8089\n352.3359 0.3963\n381.3111 1.2006\n413.3946 5.5615\n493.2604 0.3502\n506.8051 10.5561\n527.0029 1.2514\n556.6825 87.4841\n592.2553 5.8612\n599.5224 14.1978\n675.2463 0.8712\n727.5885 1.3189\n742.6621 10.8338\n777.5266 17.3208\n848.9559 4.6406\n854.1535 4.9714\n950.2721 4.0521\n969.4736 0.9518\n1026.1886 10.6672\n1045.4872 3.2823\n1059.1481 16.1625\n1071.9034 0.7088\n1083.5461 0.8123\n1107.5662 4.4090\n1138.2201 42.7691\n1208.8589 1.7336\n1229.8827 8.7420\n1249.8457 23.9380\n1284.6269 10.2459\n1332.4145 265.5673\n1342.4958 189.6857\n1438.4546 1.8781\n1446.4176 0.0738\n1448.7748 10.4501\n1456.8311 3.1426\n1493.4099 3.5216\n1510.9710 7.7304\n1523.4744 9.0332\n1527.2323 8.3076\n1539.2807 11.0581\n1543.1791 9.9459\n1545.4453 1.0233\n1625.0607 4.6091\n1649.5107 26.4774\n1852.0353 313.5939\n3031.4083 23.1873\n3040.2465 21.5785\n3044.6875 25.0393\n3094.0341 34.5508\n3096.4638 6.7132\n3100.1171 8.7217\n3128.8213 18.6340\n3159.6815 17.5517\n3163.6242 4.5940\n3188.6198 15.3818\n3222.9915 4.2231\n3741.6650 20.3632"
rotational.constants:"1.67512 GHz\n0.67117 GHz\n0.50098 GHz"
software:"Gaussian 09, Revision C.01"
contributor:"Katherine Hafner"
Time for openFile(https://webbook.nist.gov/cgi/cbook.cgi?Str3File=C1076477): 268 ms
reading 24 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
24 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