1 2 3 4 5 6 7 8 9 10 11 12 13 14 15 16 17 18 19 20 21 22 23 24 25 26
|
1SCF SNAP
comment1
comment2
C 0.0 1 0.0 1 0.0 1 0 0 0
H 1.09 1 0.0 1 0.0 1 1 0 0
H 1.09 1 109.5 1 0.0 1 1 2 0
H 1.09 1 109.5 1 120 1 1 2 3
H 1.09 1 109.5 1 240 1 1 2 3
1SCF SNAP
comment1
comment2
C 0.0 1 0.0 1 0.0 1 0 0 0
H 1.09 1 0.0 1 0.0 1 1 0 0
H 1.09 1 109.47 1 0.0 1 1 2 0
H 1.09 1 109.47 1 120 1 1 2 3
H 1.09 1 109.47 1 240 1 1 2 3
1SCF
comment1
comment2
C 0.0 1 0.0 1 0.0 1 0 0 0
H 1.09 1 0.0 1 0.0 1 1 0 0
H 1.09 1 109.47 1 0.0 1 1 2 0
H 1.09 1 109.47 1 120 1 1 2 3
H 1.09 1 109.47 1 240 1 1 2 3
|