C,1,15.0,s,
S,2,,,
C,3,29.86,s,
C,4,30.69,s,
C,5,53.85,s,
N,6,,,
C,7,171.45,s,
O,8,,,
N,9,,,
C,10,54.73,s,
C,11,35.89,s,
C,12,132.07,s,
C,13,142.42,s,
N,14,,,
C,15,145.66,s,
C,16,107.77,s,
C,17,132.45,s,
C,18,132.45,s,
C,19,131.07,s,
C,20,132.07,s,
C,21,174.85,s,
O,22,,,
O,23,,,
H,24,2.12,s,
H,25,2.12,s,
H,26,2.12,s,
H,27,2.63,dt,"12.4,6.6"
H,28,2.42,dt,"12.4,6.6"
H,29,2.11,dtd,"14.4,6.6,6.2"
H,30,2.19,dtd,"14.4,6.6,6.2"
H,31,4.13,t,6.2
H,32,,,
H,33,,,
H,34,,,
H,35,4.43,t,6.3
H,36,2.25,dd,"13.4,6.3"
H,37,3.26,dd,"13.4,6.3"
H,38,7.28,d,0.5
H,39,,,
H,40,7.83,ddd,"6.8,1.4,0.5"
H,41,7.28,ddd,"7.5,6.8,1.4"
H,42,7.36,ddd,"7.7,7.5,1.4"
H,43,7.72,ddt,"7.7,1.4,0.5"
H,44,,,
