H
C 1 B1
C 2 B2 1 A1
C 3 B3 2 A2 1 D1 0
C 4 B4 3 A3 2 D2 0
H 2 B5 1 A4 3 D3 0
Cl 3 B6 2 A5 1 D4 0
H 4 B7 3 A6 2 D5 0
H 5 B8 4 A7 3 D6 0
H 5 B9 4 A8 3 D7 0
B1 1.069
B2 1.349
B3 1.447
B4 1.341
B5 1.085
B6 1.741
B7 1.08
B8 1.079
B9 1.097
A1 119.8
A2 123.9
A3 125.8
A4 118.5
A5 118.4
A6 114.9
A7 120.5
A8 120.1
D1 0.
D2 180.
D3 180.
D4 180.
D5 0.
D6 180.
D7 0.
Approximate re bond lengths are given in parentheses
H
C,1,B1
C,2,B2,1,A1
C,3,B3,2,A2,1,D1,0
C,4,B4,3,A3,2,D2,0
H,2,B5,1,A4,3,D3,0
Cl,3,B6,2,A5,1,D4,0
H,4,B7,3,A6,2,D5,0
H,5,B8,4,A7,3,D6,0
H,5,B9,4,A8,3,D7,0
Variables:
B1=1.08098165
B2=1.3398659 (1.3360)
B3=1.45513442 (1.4560)
B4=1.33897041 (1.3351)
B5=1.07887331
B6=1.73991823 (1.7367)
B7=1.08466649
B8=1.08013308
B9=1.08052683
A1=118.96405362
A2=123.64507593
A3=125.8287573
A4=119.26493994
A5=119.30615831
A6=114.30021776
A7=120.33548963
A8=121.25718261
D1=0.
D2=180.
D3=180.
D4=180.
D5=0.
D6=180.
D7=0.