Accuracy
rep739sys047g06pt100ab
636 rep739sys047g06pt100ab
(Previous)
(Back)
(Next)
Geometry from http://www.nciatlas.org/
CHARGE=0
rep739sys047g06pt100ab
H=2.480+rep739sys047g06pt100a+rep739sys047g06pt100b HR=NCIA HWT=10
C -2.15572285 +0 0.00000000 +0 -2.10000000 +0
I 0.00000000 +1 0.00000000 +0 -2.10000000 +0
H -2.47911693 +0 1.03349130 +1 -2.10000000 +0
H -2.47994031 +0 -0.51585728 +0 -2.99503257 +0
H -2.47988418 +0 -0.51634673 +0 -1.20631410 +0
C 0.00000000 +0 0.00000000 +0 1.30176000 +0
C 1.32475009 +0 -0.00045494 +0 1.30176000 +0
H -0.56912119 +0 0.92022990 +0 1.30176000 +0
H -0.56874856 +0 -0.92036334 +0 1.30294169 +0
H 1.89349865 +0 0.91990840 +0 1.30057831 +0
H 1.89384364 +0 -0.91985323 +0 1.30231468 +0