N,1,,,
C,2,57.53,s,
C,3,34.51,s,
S,4,,,
C,5,80.81,s,
O,6,,,
N,7,,,
C,8,53.8,s,
C,9,18.2,s,
C,10,108.26,s,
C,11,134.08,s,
N,12,,,
C,13,136.33,s,
C,14,111.4,s,
C,15,123.6,s,
C,16,114.56,s,
Br,17,,,
C,18,122.2,s,
C,19,127.21,s,
C,20,57.53,s,
H,21,,,
H,22,,,
H,23,3.42,ddd,"9.6,9.4,1.7"
H,24,3.23,dd,"12.4,9.6"
H,25,3.23,dd,"12.4,9.4"
H,26,4.61,s,
H,27,4.61,s,
H,28,3.57,ddd,"12.4,4.5,1.6"
H,29,3.57,ddd,"12.8,12.4,6.7"
H,30,2.9,ddd,"15.4,12.8,4.5"
H,31,2.9,ddd,"15.4,6.7,1.6"
H,32,,,
H,33,7.38,dd,"7.1,0.5"
H,34,7.32,dd,"7.1,1.4"
H,35,7.8,dd,"1.4,0.5"
H,36,4.28,d,1.7
