C,1,55.32,s,
O,2,,,
C,3,160.17,s,
C,4,114.26,s,
C,5,128.47,s,
C,6,133.74,s,
C,7,143.45,s,
N,8,,,
C,9,152.22,s,
N,10,,,
N,11,,,
C,12,33.35,s,
C,13,153.15,s,
S,14,,,
O,15,,,
O,16,,,
O,17,,,
C,18,128.47,s,
C,19,114.26,s,
H,20,3.76,s,
H,21,3.76,s,
H,22,3.76,s,
H,23,6.89,ddd,"7.2,1.9,0.5"
H,24,7.49,ddd,"7.2,1.4,0.5"
H,25,,,
H,26,,,
H,27,3.83,s,
H,28,3.83,s,
H,29,3.83,s,
H,30,,,
H,31,7.49,ddd,"8.0,1.4,0.5"
H,32,6.89,ddd,"8.0,1.9,0.5"
