C,1,37.44,s,
N,2,,,
C,3,37.44,s,
C,4,157.64,s,
N,5,,,
S,6,,,
C,7,166.13,s,
C,8,194.75,s,
O,9,,,
C,10,115.46,s,
C,11,136.47,s,
N,12,,,
C,13,136.35,s,
C,14,112.36,s,
C,15,122.55,s,
C,16,122.05,s,
C,17,122.67,s,
C,18,126.56,s,
N,19,,,
H,20,3.24,s,
H,21,3.24,s,
H,22,3.24,s,
H,23,3.24,s,
H,24,3.24,s,
H,25,3.24,s,
H,26,8.22,d,0.5
H,27,,,
H,28,7.42,ddd,"8.2,1.4,0.5"
H,29,7.14,ddd,"8.2,7.0,1.4"
H,30,7.02,ddd,"7.2,7.0,1.4"
H,31,8.41,ddt,"7.2,1.4,0.5"
