C,1,20.93,s,
C,2,169.19,s,
O,3,,,
O,4,,,
C,5,156.64,s,
C,6,111.52,s,
C,7,148.5,s,
C,8,47.2,s,
C,9,23.47,s,
C,10,35.28,s,
C,11,28.16,s,
C,12,18.56,s,
C,13,17.4,s,
C,14,41.86,s,
C,15,23.79,s,
C,16,123.2,s,
Br,17,,,
C,18,133.6,s,
C,19,127.71,s,
C,20,15.69,s,
H,21,2.91,s,
H,22,2.91,s,
H,23,2.91,s,
H,24,6.94,d,0.5
H,25,1.27,s,
H,26,1.27,s,
H,27,1.27,s,
H,28,1.72,ddd,"12.4,8.0,1.8"
H,29,1.72,ddd,"12.4,12.2,8.3"
H,30,1.58,m,
H,31,1.58,m,
H,32,2.83,m,
H,33,0.42,dd,"5.8,2.4"
H,34,0.42,dd,"9.4,2.4"
H,35,1.13,s,
H,36,1.13,s,
H,37,1.13,s,
H,38,7.26,d,0.5
H,39,2.17,s,
H,40,2.17,s,
H,41,2.17,s,
