C,1,115.43,s,
C,2,141.82,s,
C,3,38.8,s,
C,4,73.2,s,
O,5,,,
C,6,72.6,s,
Br,7,,,
C,8,43.57,s,
C,9,22.47,s,
C,10,22.47,s,
C,11,49.0,s,
C,12,38.6,s,
C,13,29.4,s,
C,14,128.1,s,
C,15,19.35,s,
C,16,124.1,s,
Cl,17,,,
C,18,25.6,s,
H,19,4.86,s,
H,20,4.86,s,
H,21,2.52,dd,"15.4,0.3"
H,22,2.52,dd,"15.4,8.2"
H,23,4.52,ddd,"8.2,3.0,0.3"
H,24,,,
H,25,4.55,d,3.0
H,26,1.06,s,
H,27,1.06,s,
H,28,1.06,s,
H,29,1.06,s,
H,30,1.06,s,
H,31,1.06,s,
H,32,2.48,ddd,"12.4,11.8,2.1"
H,33,2.48,dd,"12.4,7.5"
H,34,2.37,dd,"15.4,11.8"
H,35,2.37,ddd,"15.4,7.5,2.1"
H,36,1.69,s,
H,37,1.69,s,
H,38,1.69,s,
H,39,1.79,s,
H,40,1.79,s,
