home
***
CD-ROM
|
disk
|
FTP
|
other
***
search
/
PC-SIG: World of Education
/
PC-SiG's World of Education.iso
/
run
/
1469
/
c2h5oh.dat
< prev
next >
Wrap
Text File
|
1988-06-26
|
2KB
|
33 lines
chemical_name("C2H5OH")
chemical(a(9,"H ",o("1s",1,"σ",3)))
chemical(a(3,"O ",o("3p(z)",1,"σ",9)))
chemical(a(8,"H ",o("1s",1,"σ",2)))
chemical(a(2,"C ",o("sp3`",1,"σ",8)))
chemical(a(7,"H ",o("1s",1,"σ",2)))
chemical(a(2,"C ",o("sp3^",1,"σ",7)))
chemical(a(6,"H ",o("1s",1,"σ",1)))
chemical(a(1,"C ",o("sp3'",1,"σ",6)))
chemical(a(5,"H ",o("1s",1,"σ",1)))
chemical(a(1,"C ",o("sp3^",1,"σ",5)))
chemical(a(4,"H ",o("1s",1,"σ",1)))
chemical(a(1,"C ",o("sp3~",1,"σ",4)))
chemical(a(3,"O ",o("3p(y)",1,"σ",2)))
chemical(a(2,"C ",o("sp3~",1,"σ",3)))
chemical(a(2,"C ",o("sp3'",1,"σ",1)))
chemical(a(1,"C ",o("sp3`",1,"σ",2)))
atomlocation(9,l(351,-2105,1336,0.375,0.15225049498,-1.9609576688,0.0037940682781,3848),1)
atomlocation(8,l(778,280,1782,0.375,6.0828349704,-1.56415019,0.00066728831551,3848),1)
atomlocation(7,l(1935,650,-324,0.375,0.80206725518,-5.7784120109,0.14096820165,3848),1)
atomlocation(6,l(-874,2143,-619,0.375,4.712387201,0,1.57079633,3848),1)
atomlocation(5,l(-2086,155,94,0.375,0.60928883931,-2.609987149,0.064796236593,3848),1)
atomlocation(4,l(-877,155,-2025,0.375,5.9431972842,-4.7099905132,0.00041168711003,3848),1)
atomlocation(3,l(877,-1909,56,0.7,3.2809067624,24.742012288,0.0043432302727,269),1)
atomlocation(2,l(768,-17,321,0.772,2.1894828727,32.466744656,0.29998843039,1290),1)
atomlocation(1,l(-874,652,-619,0.772,6.2832,6.2832,6.2832,1290),1)
commandactive("Files")
viewshown("Fnt")
grid(8)
atom_count(10)
valencelist(2,1,4)
valencelist(1,1,4)