optimized structure. Approximate re bond lengths are given
in parentheses.
C
C,1,B1
C,2,B2,1,A1
C,3,B3,2,A2,1,D1,0
C,4,B4,3,A3,2,D2,0
C,5,B5,4,A4,3,D3,0
N,6,B6,5,A5,4,D4,0
F,1,B7,2,A6,3,D5,0
F,1,B8,2,A7,3,D6,0
F,2,B9,1,A8,3,D7,0
F,2,B10,1,A9,3,D8,0
F,3,B11,2,A10,1,D9,0
F,3,B12,2,A11,1,D10,0
F,4,B13,3,A12,2,D11,0
F,4,B14,3,A13,2,D12,0
F,5,B15,4,A14,3,D13,0
F,5,B16,4,A15,3,D14,0
F,1,B17,2,A16,3,D15,0
Variables:
B1=1.54691389 (1.5456)
B2=1.55056266 (1.5491)
B3=1.55266923 (1.5511)
B4=1.55187946 (1.5504)
B5=1.47883632 (1.4805)
B6=1.15344866 (1.1544)
B7=1.32840596 (1.3321)
B8=1.32496984 (1.3287)
B9=1.33821805 (1.3421)
B10=1.34186319 (1.3458)
B11=1.34069473 (1.3446)
B12=1.34070409 (1.3446)
B13=1.3391727 (1.3430)
B14=1.340238 (1.3441)
B15=1.33853783 (1.3424)
B16=1.34205474 (1.3459)
B17=1.3262599 (1.3300)
A1=113.90944946
A2=112.78641508
A3=113.75747296
A4=110.09674494
A5=179.47489078
A6=110.23042597
A7=110.6600369
A8=107.86420948
A9=107.77403537
A10=108.27482029
A11=109.23395576
A12=108.59600804
A13=109.87575213
A14=109.67568263
A15=109.16658333
A16=108.66572007
D1=163.56533615
D2=162.42350473
D3=169.06805209
D4=64.86513053
D5=50.40888823
D6=-70.64582587
D7=-120.53738787
D8=121.47028677
D9=-75.31476445
D10=43.34301915
D11=-77.72584255
D12=41.8947354
D13=-70.75054893
D14=48.81865483
D15=169.83640715
