C,1,49.3,s,
O,2,,,
C,3,76.1,s,
C,4,20.8,s,
C,5,20.8,s,
C,6,74.9,s,
O,7,,,
C,8,70.77,s,
O,9,,,
C,10,157.06,s,
C,11,115.01,s,
C,12,126.82,s,
C,13,124.8,s,
C,14,42.0,s,
C,15,75.8,s,
S,16,,,
C,17,15.8,s,
C,18,165.5,s,
O,19,,,
N,20,,,
C,21,33.5,s,
C,22,64.8,s,
S,23,,,
C,24,13.5,s,
C,25,164.3,s,
O,26,,,
N,27,,,
C,28,30.5,s,
C,29,126.82,s,
C,30,115.01,s,
H,31,3.31,s,
H,32,3.31,s,
H,33,3.31,s,
H,34,1.35,s,
H,35,1.35,s,
H,36,1.35,s,
H,37,1.35,s,
H,38,1.35,s,
H,39,1.35,s,
H,40,4.15,t,5.5
H,41,,,
H,42,4.05,d,5.5
H,43,4.05,d,5.5
H,44,6.85,ddd,"7.7,1.9,0.5"
H,45,6.92,ddd,"7.7,1.9,0.5"
H,46,2.05,s,
H,47,2.05,s,
H,48,1.74,s,
H,49,1.74,s,
H,50,1.74,s,
H,51,3.01,s,
H,52,3.01,s,
H,53,3.01,s,
H,54,5.53,s,
H,55,2.09,s,
H,56,2.09,s,
H,57,2.09,s,
H,58,3.35,s,
H,59,3.35,s,
H,60,3.35,s,
H,61,6.92,ddd,"8.1,1.9,0.5"
H,62,6.85,ddd,"8.1,1.9,0.5"
