structure. Approximate re bond lengths are given in
parentheses.
C
C,1,B1
F,1,B2,2,A1
F,1,B3,2,A2,3,D1,0
F,2,B4,1,A3,3,D2,0
F,2,B5,1,A4,3,D3,0
F,2,B6,1,A5,3,D4,0
C,1,B7,2,A6,5,D5,0
O,8,B8,1,A7,2,D6,0
Cl,8,B9,1,A8,2,D7,0
Variables:
B1=1.5424995 (1.5394)
B2=1.3406583 (1.3393)
B3=1.3406583 (1.3393)
B4=1.32737803 (1.3263)
B5=1.32495065 (1.3240)
B6=1.32495065 (1.3240)
B7=1.54193929 (1.5388)
B8=1.18932424 (1.1843)
B9=1.73970465 (1.7439)
A1=108.17634648
A2=108.17634648
A3=108.88650367
A4=110.1871086
A5=110.1871086
A6=112.81656168
A7=124.40002756
A8=111.23869109
D1=118.05935183
D2=-59.02967591
D3=60.36296883
D4=-178.42232066
D5=180.
D6=0.
D7=180.
structure. Approximate re bond lengths are given in
parentheses.
C
C,1,B1
F,1,B2,2,A1
F,1,B3,2,A2,3,D1,0
F,2,B4,1,A3,3,D2,0
F,2,B5,1,A4,3,D3,0
F,2,B6,1,A5,3,D4,0
C,1,B7,2,A6,5,D5,0
O,8,B8,1,A7,2,D6,0
Cl,8,B9,1,A8,2,D7,0
Variables:
B1=1.54276617 (1.5397)
B2=1.34482115 (1.3387)
B3=1.34482115 (1.3387)
B4=1.33112936 (1.3252)
B5=1.32922323 (1.3234)
B6=1.32922323 (1.3234)
B7=1.54224424 (1.5392)
B8=1.19170856 (1.1836)
B9=1.74823373 (1.7450)
A1=108.22700281
A2=108.22700281
A3=109.08059804
A4=110.25644151
A5=110.25644151
A6=112.93095127
A7=124.66211235
A8=111.01192264
D1=117.900753
D2=-58.9503765
D3=60.47996085
D4=-178.38071385
D5=180.
D6=0.
D7=180.