Accuracy
rep739sys029g10pt100ab
516 rep739sys029g10pt100ab
(Previous)
(Back)
(Next)
Geometry from http://www.nciatlas.org/
CHARGE=0
rep739sys029g10pt100ab
H=2.308+rep739sys029g10pt100a+rep739sys029g10pt100b HR=NCIA HWT=10
C -1.79549575 +0 0.00000000 +0 -1.78000000 +0
Cl 0.00000000 +1 0.00000000 +0 -1.78000000 +0
H -2.13568202 +0 1.03004238 +1 -1.78000000 +0
H -2.13621168 +0 -0.51377680 +0 -2.67122166 +0
H -2.13602844 +0 -0.51367939 +0 -0.88848614 +0
C 0.00000000 +0 0.00000000 +0 1.56294314 +0
H 0.00000000 +0 0.00000000 +0 0.47517800 +0
H 0.82483410 +0 0.61049815 +0 1.92529342 +0
H -0.93959881 +0 0.40839483 +0 1.92617412 +0
H 0.11717033 +0 -1.01889374 +0 1.92558852 +0