C,1,51.3,s,
O,2,,,
C,3,173.93,s,
O,4,,,
C,5,49.53,s,
C,6,51.85,s,
C,7,70.3,s,
C,8,28.75,s,
Cl,9,,,
C,10,60.8,s,
Br,11,,,
C,12,42.67,s,
C,13,41.86,s,
C,14,41.86,s,
C,15,23.79,s,
C,16,23.79,s,
C,17,121.24,s,
Br,18,,,
C,19,133.9,s,
C,20,58.3,s,
O,21,,,
C,22,67.39,s,
C,23,18.52,s,
H,24,3.62,s,
H,25,3.62,s,
H,26,3.62,s,
H,27,2.86,dd,"11.7,3.2"
H,28,3.12,dd,"12.4,11.7"
H,29,3.12,dd,"12.4,3.2"
H,30,1.79,s,
H,31,1.79,s,
H,32,1.79,s,
H,33,4.08,dd,"10.6,4.9"
H,34,2.05,dd,"12.4,4.9"
H,35,2.05,dd,"12.4,10.6"
H,36,1.13,s,
H,37,1.13,s,
H,38,1.13,s,
H,39,1.13,s,
H,40,1.13,s,
H,41,1.13,s,
H,42,6.5,d,6.6
H,43,3.28,d,6.6
H,44,1.28,s,
H,45,1.28,s,
H,46,1.28,s,
