C,1,13.65,s,
C,2,111.45,s,
C,3,148.5,s,
N,4,,,
C,5,137.02,s,
S,6,,,
C,7,164.02,s,
O,8,,,
O,9,,,
C,10,80.31,s,
C,11,80.31,s,
O,12,,,
C,13,97.88,s,
C,14,36.76,s,
C,15,83.52,s,
O,16,,,
C,17,49.1,s,
C,18,77.48,s,
O,19,,,
C,20,76.98,s,
C,21,13.99,s,
O,22,,,
C,23,175.75,s,
O,24,,,
C,25,41.07,s,
C,26,16.27,s,
C,27,26.69,s,
C,28,11.76,s,
C,29,76.98,s,
C,30,13.99,s,
O,31,,,
C,32,74.9,s,
O,33,,,
C,34,78.54,s,
C,35,82.95,s,
O,36,,,
C,37,48.61,s,
C,38,197.5,s,
O,39,,,
C,40,151.21,s,
N,41,,,
C,42,103.22,s,
C,43,169.1,s,
O,44,,,
O,45,,,
C,46,196.96,s,
O,47,,,
O,48,,,
C,49,77.65,s,
C,50,62.68,s,
O,51,,,
C,52,170.43,s,
C,53,20.67,s,
O,54,,,
H,55,1.83,d,7.0
H,56,1.83,d,7.0
H,57,1.83,d,7.0
H,58,5.74,q,7.0
H,59,5.3,dd,"4.4,3.5"
H,60,4.35,dd,"3.5,1.9"
H,61,5.19,dd,"10.0,4.9"
H,62,2.03,ddd,"12.4,12.3,10.0"
H,63,2.03,ddd,"12.4,4.9,3.1"
H,64,4.54,dd,"12.3,3.1"
H,65,3.28,s,
H,66,3.28,s,
H,67,3.28,s,
H,68,,,
H,69,5.02,q,6.3
H,70,1.46,d,6.3
H,71,1.46,d,6.3
H,72,1.46,d,6.3
H,73,2.34,qt,"6.7,6.1"
H,74,1.14,d,6.7
H,75,1.14,d,6.7
H,76,1.14,d,6.7
H,77,1.69,qd,"7.0,6.1"
H,78,1.69,qd,"7.0,6.1"
H,79,0.91,t,7.0
H,80,0.91,t,7.0
H,81,0.91,t,7.0
H,82,5.02,q,6.2
H,83,1.46,d,6.2
H,84,1.46,d,6.2
H,85,1.46,d,6.2
H,86,3.9,dd,"10.1,1.9"
H,87,,,
H,88,4.76,d,10.1
H,89,,,
H,90,2.84,s,
H,91,2.84,s,
H,92,,,
H,93,,,
H,94,,,
H,95,3.65,td,"5.4,4.4"
H,96,4.31,d,5.4
H,97,4.31,d,5.4
H,98,2.02,s,
H,99,2.02,s,
H,100,2.02,s,
