C,1,57.81,s,
O,2,,,
C,3,76.12,s,
C,4,38.78,s,
C,5,145.24,s,
N,6,,,
C,7,138.49,s,
C,8,116.8,s,
C,9,132.0,s,
C,10,124.5,s,
C,11,123.4,s,
C,12,125.4,s,
C,13,124.83,s,
C,14,111.03,s,
C,15,137.91,s,
N,16,,,
C,17,131.57,s,
C,18,167.36,s,
O,19,,,
H,20,3.42,s,
H,21,3.42,s,
H,22,3.42,s,
H,23,4.68,dd,"4.6,1.4"
H,24,2.35,dd,"15.4,4.6"
H,25,2.35,dd,"15.4,1.4"
H,26,8.19,d,4.0
H,27,7.12,dd,"4.0,0.5"
H,28,8.2,ddt,"7.2,1.4,0.5"
H,29,7.32,ddd,"7.2,6.9,1.4"
H,30,7.43,ddd,"6.9,6.8,1.4"
H,31,7.54,ddd,"6.8,1.4,0.5"
