C,1,27.15,s,
S,2,,,
O,3,,,
C,4,42.92,s,
C,5,27.67,s,
C,6,26.61,s,
C,7,24.81,s,
C,8,30.5,s,
C,9,153.0,s,
N,10,,,
O,11,,,
S,12,,,
O,13,,,
O,14,,,
O,15,,,
S,16,,,
C,17,82.5,s,
O,18,,,
C,19,80.8,s,
C,20,61.3,s,
O,21,,,
C,22,70.38,s,
O,23,,,
C,24,77.9,s,
O,25,,,
C,26,73.0,s,
O,27,,,
H,28,3.08,s,
H,29,3.08,s,
H,30,3.08,s,
H,31,4.76,t,6.5
H,32,4.76,t,6.5
H,33,2.52,tt,"6.6,6.5"
H,34,2.52,tt,"6.6,6.5"
H,35,1.37,m,6.6
H,36,1.37,m,6.6
H,37,1.66,tt,"6.8,6.6"
H,38,1.66,tt,"6.8,6.6"
H,39,2.05,t,6.8
H,40,2.05,t,6.8
H,41,,,
H,42,5.04,d,1.5
H,43,3.54,td,"5.4,2.4"
H,44,3.74,d,5.4
H,45,3.74,d,5.4
H,46,,,
H,47,3.81,dd,"3.1,2.4"
H,48,,,
H,49,3.48,dd,"5.2,3.1"
H,50,,,
H,51,3.68,dd,"5.2,1.5"
H,52,,,
