C,1,15.1,s,
S,2,,,
C,3,80.76,s,
C,4,61.05,s,
O,5,,,
C,6,165.39,s,
O,7,,,
N,8,,,
C,9,82.5,s,
N,10,,,
C,11,147.68,s,
C,12,110.57,s,
C,13,129.2,s,
C,14,119.68,s,
C,15,123.2,s,
C,16,131.6,s,
C,17,58.9,s,
C,18,114.9,s,
C,19,122.9,s,
N,20,,,
C,21,137.35,s,
C,22,111.72,s,
C,23,122.28,s,
C,24,119.88,s,
C,25,121.55,s,
C,26,125.8,s,
C,27,80.2,s,
O,28,,,
C,29,73.1,s,
S,30,,,
C,31,15.4,s,
C,32,165.39,s,
O,33,,,
N,34,,,
C,35,28.11,s,
H,36,1.74,s,
H,37,1.74,s,
H,38,1.74,s,
H,39,4.1,s,
H,40,4.1,s,
H,41,,,
H,42,5.27,s,
H,43,,,
H,44,6.67,ddd,"7.8,1.4,0.5"
H,45,7.09,td,"7.8,1.4"
H,46,6.94,ddd,"9.9,7.8,1.4"
H,47,7.25,ddd,"9.9,1.4,0.5"
H,48,7.51,d,0.5
H,49,,,
H,50,7.38,ddd,"7.5,1.4,0.5"
H,51,7.14,ddd,"7.7,7.5,1.4"
H,52,7.15,ddd,"7.9,7.7,1.4"
H,53,8.02,ddt,"7.9,1.4,0.5"
H,54,4.52,s,
H,55,,,
H,56,1.74,s,
H,57,1.74,s,
H,58,1.74,s,
H,59,3.35,s,
H,60,3.35,s,
H,61,3.35,s,
