C,1,55.87,s,
O,2,,,
C,3,153.0,s,
C,4,110.3,s,
C,5,123.9,s,
C,6,122.37,s,
C,7,166.0,s,
O,8,,,
O,9,,,
C,10,73.03,s,
C,11,30.57,s,
C,12,27.95,s,
C,13,43.82,s,
C,14,18.07,s,
C,15,40.4,s,
C,16,28.16,s,
C,17,28.16,s,
C,18,40.4,s,
C,19,92.55,s,
C,20,50.9,s,
C,21,76.45,s,
O,22,,,
C,23,52.8,s,
C,24,53.83,s,
N,25,,,
C,26,53.83,s,
C,27,31.16,s,
C,28,19.5,s,
C,29,31.28,s,
C,30,29.71,s,
C,31,66.72,s,
C,32,77.48,s,
C,33,25.81,s,
O,34,,,
C,35,69.4,s,
O,36,,,
C,37,74.36,s,
O,38,,,
C,39,40.59,s,
C,40,76.45,s,
O,41,,,
O,42,,,
C,43,109.6,s,
O,44,,,
C,45,112.0,s,
C,46,148.6,s,
O,47,,,
C,48,55.87,s,
H,49,3.85,s,
H,50,3.85,s,
H,51,3.85,s,
H,52,6.86,dd,"7.5,0.5"
H,53,7.61,dd,"7.5,1.9"
H,54,5.2,dd,"10.4,4.2"
H,55,1.8,m,
H,56,1.8,m,
H,57,1.72,ddd,"12.4,10.0,1.1"
H,58,1.72,ddd,"12.4,10.2,8.8"
H,59,1.02,s,
H,60,1.02,s,
H,61,1.02,s,
H,62,2.41,dd,"3.2,2.5"
H,63,1.58,m,
H,64,1.58,m,
H,65,1.58,tdd,"12.4,10.5,8.1"
H,66,1.58,m,
H,67,2.39,dd,"12.4,3.9"
H,68,1.66,s,
H,69,1.66,s,
H,70,,,
H,71,2.83,dd,"9.7,9.5"
H,72,3.31,dd,"12.4,9.7"
H,73,3.31,dd,"12.4,9.5"
H,74,2.71,dd,"12.4,2.6"
H,75,2.71,dd,"12.4,9.7"
H,76,1.92,m,
H,77,0.97,d,6.4
H,78,0.97,d,6.4
H,79,0.97,d,6.4
H,80,1.58,m,
H,81,1.58,m,
H,82,1.84,m,
H,83,1.84,m,
H,84,3.84,dd,"10.2,4.2"
H,85,1.4,s,
H,86,1.4,s,
H,87,1.4,s,
H,88,,,
H,89,,,
H,90,4.08,dd,"9.0,8.2"
H,91,,,
H,92,2.27,dd,"12.4,9.0"
H,93,2.27,dd,"12.4,8.2"
H,94,,,
H,95,,,
H,96,7.56,dd,"1.9,0.5"
H,97,3.8,s,
H,98,3.8,s,
H,99,3.8,s,
