C,1,19.2,s,
S,2,,,
C,3,148.2,s,
C,4,124.97,s,
C,5,177.37,s,
O,6,,,
C,7,132.61,s,
Br,8,,,
C,9,127.06,s,
C,10,41.86,s,
C,11,114.8,s,
C,12,136.89,s,
N,13,,,
C,14,138.8,s,
C,15,132.07,s,
C,16,143.45,s,
N,17,,,
C,18,139.84,s,
C,19,112.9,s,
C,20,123.4,s,
C,21,132.2,s,
N,22,,,
C,23,37.3,s,
C,24,117.9,s,
C,25,117.4,s,
C,26,168.25,s,
O,27,,,
H,28,2.43,s,
H,29,2.43,s,
H,30,2.43,s,
H,31,6.74,s,
H,32,8.17,s,
H,33,6.44,d,11.0
H,34,7.62,d,11.0
H,35,,,
H,36,8.19,dd,"4.2,0.5"
H,37,7.56,dd,"4.2,1.4"
H,38,8.25,dd,"1.4,0.5"
H,39,4.27,s,
H,40,4.27,s,
H,41,4.27,s,
