Approximate equilibrium bond lengths are given in
parentheses.
C
O,1,B1
C,1,B2,2,A1
C,1,B3,2,A2,3,D1,0
Cl,4,B4,1,A3,2,D2,0
H,3,B5,1,A4,2,D3,0
H,3,B6,1,A5,2,D4,0
H,3,B7,1,A6,2,D5,0
F,4,B8,1,A7,2,D6,0
F,4,B9,1,A8,2,D7,0
Variables:
B1=1.20975522 (1.2028)
B2=1.49780582 (1.4968)
B3=1.54605167 (1.5429)
B4=1.77131825 (1.7681)
B5=1.09024528
B6=1.08527334
B7=1.08877669
B8=1.34944686 (1.3432)
B9=1.33025 (1.3244)
A1=125.696365
A2=118.94513881
A3=108.61061513
A4=108.94366982
A5=109.12166435
A6=110.59743515
A7=110.24506125
A8=111.52984223
D1=-179.90137726
D2=101.10772009
D3=108.88511349
D4=-11.11595771
D5=-133.1720399
D6=-139.69245256
D7=-19.67505014
