C,1,14.03,s,
C,2,22.6,s,
C,3,31.8,s,
C,4,25.4,s,
C,5,36.68,s,
C,6,70.05,s,
O,7,,,
C,8,40.77,s,
C,9,171.34,s,
O,10,,,
O,11,,,
C,12,80.25,s,
C,13,102.57,s,
C,14,150.18,s,
O,15,,,
C,16,153.07,s,
C,17,132.07,s,
C,18,30.5,s,
C,19,75.8,s,
S,20,,,
C,21,15.8,s,
C,22,165.39,s,
O,23,,,
N,24,,,
C,25,57.53,s,
C,26,132.07,s,
C,27,153.07,s,
O,28,,,
C,29,150.18,s,
C,30,102.57,s,
C,31,80.25,s,
O,32,,,
C,33,171.34,s,
O,34,,,
C,35,40.77,s,
C,36,70.05,s,
O,37,,,
C,38,36.68,s,
C,39,25.4,s,
C,40,31.8,s,
C,41,22.6,s,
C,42,14.03,s,
C,43,30.5,s,
C,44,75.8,s,
S,45,,,
C,46,15.8,s,
C,47,165.39,s,
O,48,,,
N,49,,,
C,50,57.53,s,
H,51,0.88,t,7.0
H,52,0.88,t,7.0
H,53,0.88,t,7.0
H,54,1.34,qt,"7.0,6.5"
H,55,1.34,qt,"7.0,6.5"
H,56,1.33,tt,"6.6,6.5"
H,57,1.33,tt,"6.6,6.5"
H,58,1.39,m,6.6
H,59,1.39,m,6.6
H,60,1.54,td,"6.6,5.6"
H,61,1.54,td,"6.6,5.6"
H,62,3.93,tt,"5.8,5.6"
H,63,,,
H,64,2.52,d,5.8
H,65,2.52,d,5.8
H,66,5.52,dd,"10.0,2.8"
H,67,4.82,dd,"8.0,2.8"
H,68,6.31,d,8.0
H,69,6.63,s,
H,70,3.92,s,
H,71,3.92,s,
H,72,1.74,s,
H,73,1.74,s,
H,74,1.74,s,
H,75,5.11,d,1.0
H,76,6.63,s,
H,77,6.31,d,8.0
H,78,4.82,dd,"8.0,6.6"
H,79,5.52,dd,"6.6,1.0"
H,80,2.52,d,5.8
H,81,2.52,d,5.8
H,82,3.93,tt,"5.8,5.6"
H,83,,,
H,84,1.54,td,"6.6,5.6"
H,85,1.54,td,"6.6,5.6"
H,86,1.39,m,6.6
H,87,1.39,m,6.6
H,88,1.33,tt,"6.6,6.5"
H,89,1.33,tt,"6.6,6.5"
H,90,1.34,qt,"7.0,6.5"
H,91,1.34,qt,"7.0,6.5"
H,92,0.88,t,7.0
H,93,0.88,t,7.0
H,94,0.88,t,7.0
H,95,3.92,s,
H,96,3.92,s,
H,97,1.74,s,
H,98,1.74,s,
H,99,1.74,s,
H,100,5.11,d,10.0
