C,1,10.38,s,
C,2,29.76,s,
C,3,51.64,s,
C,4,20.23,s,
N,5,,,
C,6,112.85,s,
C,7,145.66,s,
N,8,,,
C,9,157.99,s,
C,10,143.45,s,
C,11,119.28,s,
C,12,126.67,s,
C,13,105.7,s,
Br,14,,,
N,15,,,
C,16,102.7,s,
C,17,142.7,s,
O,18,,,
C,19,57.75,s,
H,20,1.06,t,7.0
H,21,1.06,t,7.0
H,22,1.06,t,7.0
H,23,1.63,qd,"7.0,5.6"
H,24,1.63,qd,"7.0,5.6"
H,25,3.62,qt,"6.2,5.6"
H,26,1.29,d,6.2
H,27,1.29,d,6.2
H,28,1.29,d,6.2
H,29,,,
H,30,6.5,s,
H,31,7.31,d,4.2
H,32,7.06,d,4.2
H,33,,,
H,34,5.7,s,
H,35,3.74,s,
H,36,3.74,s,
H,37,3.74,s,
