C,1,21.87,s,
C,2,30.97,s,
C,3,21.87,s,
C,4,46.95,s,
C,5,42.11,s,
C,6,33.31,s,
C,7,28.78,s,
C,8,28.78,s,
C,9,46.67,s,
C,10,77.48,s,
O,11,,,
C,12,71.15,s,
C,13,30.5,s,
C,14,66.05,s,
Br,15,,,
C,16,77.48,s,
C,17,25.81,s,
O,18,,,
H,19,0.88,d,6.4
H,20,0.88,d,6.4
H,21,0.88,d,6.4
H,22,1.87,m,"6.4,5.5"
H,23,0.88,d,6.4
H,24,0.88,d,6.4
H,25,0.88,d,6.4
H,26,2.13,ddd,"10.8,5.5,4.8"
H,27,2.04,dd,"12.4,10.8"
H,28,2.04,dd,"12.4,4.8"
H,29,0.97,s,
H,30,0.97,s,
H,31,0.97,s,
H,32,0.97,s,
H,33,0.97,s,
H,34,0.97,s,
H,35,2.06,s,
H,36,2.06,s,
H,37,2.61,dd,"12.4,7.2"
H,38,2.61,dd,"12.4,11.5"
H,39,3.88,dd,"11.5,7.2"
H,40,1.4,s,
H,41,1.4,s,
H,42,1.4,s,
H,43,,,
