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ASPARAGI.DAT
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1988-06-26
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3KB
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61 lines
chemical_name("Asparagine (Amino Acid)")
chemical(a(17,"H ",o("1s",1,"σ",14)))
chemical(a(14,"N ",o("sp2'",1,"σ",17)))
chemical(a(16,"H ",o("1s",1,"σ",14)))
chemical(a(14,"N ",o("sp2^",1,"σ",16)))
chemical(a(15,"O ",o("3p(y)",1,"σ",4)))
chemical(a(4,"C ",o("sp2^",1,"σ",15)))
chemical(a(14,"N ",o("sp2`",1,"σ",4)))
chemical(a(4,"C ",o("sp2'",1,"σ",14)))
chemical(a(13,"H ",o("1s",1,"σ",3)))
chemical(a(3,"C ",o("sp3_6^",1,"σ",13)))
chemical(a(12,"H ",o("1s",1,"σ",3)))
chemical(a(3,"C ",o("sp3_6~",1,"σ",12)))
chemical(a(11,"H ",o("1s",1,"σ",2)))
chemical(a(2,"C ",o("sp3_6^",1,"σ",11)))
chemical(a(10,"H ",o("2p(x)",1,"σ",7)))
chemical(a(7,"N ",o("sp3~",1,"σ",10)))
chemical(a(9,"H ",o("1s",1,"σ",7)))
chemical(a(7,"N ",o("sp3'",1,"σ",9)))
chemical(a(8,"H ",o("1s",1,"σ",7)))
chemical(a(7,"N ",o("sp3`",1,"σ",8)))
chemical(a(7,"N ",o("sp3^",1,"σ",2)))
chemical(a(2,"C ",o("sp3_6~",1,"σ",7)))
chemical(a(6,"O ",o("3p(y)",1,"σ",1)))
chemical(a(1,"C ",o("sp2'",1,"σ",6)))
chemical(a(5,"O ",o("3p(y)",1,"σ",1)))
chemical(a(1,"C ",o("sp2^",1,"σ",5)))
chemical(a(4,"C ",o("sp2`",1,"σ",3)))
chemical(a(3,"C ",o("sp3_6`",1,"σ",4)))
chemical(a(3,"C ",o("sp3_6'",1,"σ",2)))
chemical(a(2,"C ",o("sp3_6'",1,"σ",3)))
chemical(a(2,"C ",o("sp3_6`",1,"σ",1)))
chemical(a(1,"C ",o("sp2`",1,"σ",2)))
atomlocation(17,l(-4126,-303,-89,0.375,0,-4.18878265,0,3848),1)
atomlocation(16,l(-4126,-303,2331,0.375,0,-2.0945973428,0,3848),1)
atomlocation(15,l(-715,-303,2687,0.7,1.57079633,31.939320834,0,269),1)
atomlocation(14,l(-3427,-303,1121,0.7,0,61.784660426,0,3596),1)
atomlocation(13,l(-1212,-1286,-1306,0.375,5.4315177602,-4.1889973392,0.18645658392,3848),1)
atomlocation(12,l(-1212,680,-1306,0.375,0.85166577076,-4.1889973392,6.0967269471,3848),1)
atomlocation(11,l(1602,-1286,415,0.375,0.85166819309,-1.0473899998,6.0967225858,3848),1)
atomlocation(10,l(3031,1330,238,0.375,0.67874941873,-5.9531220827,0.057747115133,3848),1)
atomlocation(9,l(1820,527,1997,0.375,0.32794780877,-1.5195534184,6.2748965301,3848),1)
atomlocation(8,l(912,2092,606,0.375,1.5076938483,-3.2253127848,5.4413401027,3848),1)
atomlocation(7,l(1752,977,676,0.7,5.0437759447,1.5626099966,0.14961552833,3596),1)
atomlocation(6,l(3817,-303,-2011,0.7,1.57079633,32.98672287,0,269),1)
atomlocation(5,l(1105,-303,-3577,0.7,4.712387211,25.656144907,0,269),1)
atomlocation(4,l(-1619,-303,1121,0.691,0,62.831855737,0,1290),1)
atomlocation(3,l(-715,-303,-445,0.7,0,-3.14159265,0,1290),1)
atomlocation(2,l(1105,-303,-445,0.7,0,62.831867773,0,1290),1)
atomlocation(1,l(2009,-303,-2011,0.691,6.2832,6.2832,6.2832,1290),1)
commandactive("Files")
viewshown("Top")
grid(8)
atom_count(18)
valencelist(14,1,5)
valencelist(7,1,5)
valencelist(4,1,4)
valencelist(3,1,4)
valencelist(2,1,4)
valencelist(1,1,4)