C,1,23.79,s,
C,2,41.86,s,
C,3,23.79,s,
C,4,44.86,s,
C,5,59.33,s,
Cl,6,,,
C,7,87.49,s,
C,8,40.4,s,
C,9,37.99,s,
C,10,172.36,s,
O,11,,,
N,12,,,
C,13,141.66,s,
C,14,103.5,s,
C,15,157.99,s,
N,16,,,
C,17,158.66,s,
O,18,,,
N,19,,,
C,20,87.49,s,
N,21,,,
C,22,142.35,s,
C,23,110.51,s,
C,24,122.9,s,
Br,25,,,
C,26,131.28,s,
C,27,127.92,s,
C,28,137.03,s,
H,29,1.11,s,
H,30,1.11,s,
H,31,1.11,s,
H,32,1.11,s,
H,33,1.11,s,
H,34,1.11,s,
H,35,3.06,dd,"12.4,6.7"
H,36,3.06,dd,"12.4,9.4"
H,37,4.51,dd,"9.4,6.7"
H,38,2.83,dd,"11.2,8.2"
H,39,2.7,dd,"18.4,11.2"
H,40,2.7,dd,"18.4,8.2"
H,41,7.69,d,12.0
H,42,6.8,d,12.0
H,43,,,
H,44,8.11,dd,"1.4,0.5"
H,45,7.58,dd,"6.9,1.4"
H,46,7.56,dd,"6.9,0.5"
