//edit the following lines 

var MSfilName="butane.jdx";
var MolfilName="butane.mol";
var xMSVals = new Array(15,27,28,29,39,41,42,43,58);
var wMSVals = new Array(0.5,0.5,0.5,0.5,0.5,0.5,0.5,0.5,0.5);

var MSxyzFile = new Array("but15.xyz","but27.xyz","but28.xyz","but29.xyz",
"but39.xyz","but41.xyz","but42.xyz","but43.xyz","butane.mol");

var ShowDesc="T";
var MSxyzDesc= new Array(
"CH3 15","CH3-C 27","CH3-CH 28",
"CH3-CH2 29","peak at 39","peak at 41",
"peak at 42","-CH3 43 set to 100%","molecular ion  58");

var numMSPeaks=9;

var title="MS of butane";
var author="Prof Robert John Lancashire";
var address1="Department of Chemistry";
var address2="University of the West Indies"; 
var address3="Mona, Kingston 7, JAMAICA";
var lastMod="16th April, 2005";

//you should not need to edit the html files.