C,1,25.83,s,
C,2,76.95,s,
C,3,25.83,s,
O,4,,,
C,5,77.48,s,
C,6,25.81,s,
C,7,38.58,s,
C,8,28.16,s,
C,9,38.46,s,
C,10,71.3,s,
C,11,23.6,s,
Cl,12,,,
C,13,62.56,s,
Br,14,,,
C,15,38.91,s,
C,16,74.36,s,
O,17,,,
C,18,38.03,s,
C,19,66.05,s,
Br,20,,,
H,21,1.75,s,
H,22,1.75,s,
H,23,1.75,s,
H,24,1.75,s,
H,25,1.75,s,
H,26,1.75,s,
H,27,1.3,s,
H,28,1.3,s,
H,29,1.3,s,
H,30,1.63,m,
H,31,1.58,m,
H,32,1.58,m,
H,33,2.38,ddd,"12.4,5.0,4.2"
H,34,2.38,ddd,"12.9,12.4,1.9"
H,35,1.79,s,
H,36,1.79,s,
H,37,1.79,s,
H,38,4.08,dd,"12.1,3.8"
H,39,2.05,ddd,"12.4,12.1,11.5"
H,40,2.05,ddd,"12.4,8.1,3.8"
H,41,4.08,dd,"11.4,6.2"
H,42,,,
H,43,2.18,ddd,"12.4,6.2,4.8"
H,44,2.18,ddd,"12.4,12.0,11.4"
H,45,3.88,dd,"12.0,4.8"
