C,1,22.4,s,
C,2,135.7,s,
C,3,22.4,s,
C,4,127.8,s,
C,5,66.7,s,
O,6,,,
C,7,44.46,s,
C,8,137.08,s,
C,9,19.61,s,
C,10,146.71,s,
C,11,31.9,s,
C,12,38.19,s,
C,13,68.0,s,
C,14,24.2,s,
Br,15,,,
C,16,67.6,s,
Cl,17,,,
C,18,30.5,s,
H,19,1.66,s,
H,20,1.66,s,
H,21,1.66,s,
H,22,1.66,s,
H,23,1.66,s,
H,24,1.66,s,
H,25,5.16,d,7.0
H,26,4.57,dt,"7.0,6.1"
H,27,,,
H,28,2.63,d,6.1
H,29,2.63,d,6.1
H,30,1.88,s,
H,31,1.88,s,
H,32,1.88,s,
H,33,2.37,ddd,"15.4,4.6,2.1"
H,34,2.37,ddd,"15.4,13.2,4.7"
H,35,2.03,ddd,"13.2,12.4,4.6"
H,36,2.03,ddd,"12.4,4.7,2.1"
H,37,1.84,s,
H,38,1.84,s,
H,39,1.84,s,
H,40,4.88,dd,"3.9,3.2"
H,41,2.05,dd,"15.4,3.2"
H,42,2.05,dd,"15.4,3.9"
