C,1,26.1,s,
C,2,37.1,s,
C,3,26.1,s,
C,4,42.11,s,
C,5,43.82,s,
C,6,59.0,s,
C,7,35.22,s,
C,8,35.22,s,
C,9,62.16,s,
C,10,65.4,s,
O,11,,,
O,12,,,
C,13,62.7,s,
C,14,62.7,s,
O,15,,,
C,16,28.16,s,
C,17,34.5,s,
C,18,65.7,s,
Br,19,,,
H,20,1.13,s,
H,21,1.13,s,
H,22,1.13,s,
H,23,1.13,s,
H,24,1.13,s,
H,25,1.13,s,
H,26,2.04,dd,"12.4,4.6"
H,27,2.04,dd,"12.7,12.4"
H,28,1.63,m,
H,29,1.9,ddd,"12.4,4.3,2.5"
H,30,1.9,ddd,"14.1,12.4,2.7"
H,31,1.9,ddd,"14.1,12.4,2.5"
H,32,1.9,ddd,"12.4,4.3,2.7"
H,33,3.92,s,
H,34,3.92,s,
H,35,,,
H,36,3.36,s,
H,37,3.36,s,
H,38,1.58,ddt,"12.4,7.7,0.8"
H,39,1.58,m,
H,40,2.52,m,
H,41,2.52,m,
H,42,4.32,dd,"9.5,8.1"
