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,7,28.76,s,
C,8,24.81,s,
C,9,30.5,s,
C,10,153.0,s,
N,11,,,
O,12,,,
S,13,,,
O,14,,,
O,15,,,
O,16,,,
S,17,,,
C,18,82.5,s,
O,19,,,
C,20,80.8,s,
C,21,61.3,s,
O,22,,,
C,23,70.38,s,
O,24,,,
C,25,77.9,s,
O,26,,,
C,27,73.0,s,
O,28,,,
H,29,3.08,s,
H,30,3.08,s,
H,31,3.08,s,
H,32,4.76,t,6.5
H,33,4.76,t,6.5
H,34,2.52,tt,"6.6,6.5"
H,35,2.52,tt,"6.6,6.5"
H,36,1.37,m,6.6
H,37,1.37,m,6.6
H,38,1.35,m,6.6
H,39,1.35,m,6.6
H,40,1.66,tt,"6.8,6.6"
H,41,1.66,tt,"6.8,6.6"
H,42,2.05,t,6.8
H,43,2.05,t,6.8
H,44,,,
H,45,5.04,d,2.2
H,46,3.54,dt,"9.9,5.4"
H,47,3.74,d,5.4
H,48,3.74,d,5.4
H,49,,,
H,50,3.81,dd,"9.9,7.4"
H,51,,,
H,52,3.48,dd,"7.4,1.4"
H,53,,,
H,54,3.68,dd,"2.2,1.4"
H,55,,,
