C,1,55.99,s,
O,2,,,
C,3,145.52,s,
C,4,110.6,s,
C,5,124.7,s,
C,6,128.85,s,
C,7,113.4,s,
C,8,143.4,s,
O,9,,,
C,10,64.0,s,
C,11,39.73,s,
C,12,134.0,s,
C,13,124.1,s,
C,14,120.41,s,
C,15,154.2,s,
O,16,,,
C,17,145.43,s,
C,18,136.32,s,
O,19,,,
C,20,147.92,s,
O,21,,,
C,22,56.33,s,
C,23,109.89,s,
C,24,128.7,s,
C,25,125.03,s,
C,26,35.29,s,
C,27,62.2,s,
C,28,127.11,s,
C,29,125.03,s,
C,30,149.4,s,
O,31,,,
C,32,60.7,s,
C,33,137.25,s,
O,34,,,
C,35,60.93,s,
C,36,145.31,s,
O,37,,,
C,38,60.33,s,
C,39,124.28,s,
C,40,23.0,s,
C,41,50.18,s,
N,42,,,
C,43,43.72,s,
C,44,120.41,s,
C,45,124.1,s,
N,46,,,
C,47,42.39,s,
C,48,47.8,s,
C,49,24.4,s,
H,50,3.86,s,
H,51,3.86,s,
H,52,3.86,s,
H,53,6.65,d,0.5
H,54,6.69,d,0.5
H,55,,,
H,56,4.39,t,6.2
H,57,3.66,d,6.2
H,58,3.66,d,6.2
H,59,7.22,ddd,"7.3,1.9,0.5"
H,60,7.06,ddd,"7.3,1.9,0.5"
H,61,,,
H,62,3.84,s,
H,63,3.84,s,
H,64,3.84,s,
H,65,7.34,s,
H,66,3.01,dd,"15.4,10.0"
H,67,3.01,dd,"15.4,1.9"
H,68,2.97,dd,"10.0,1.9"
H,69,3.84,s,
H,70,3.84,s,
H,71,3.84,s,
H,72,3.83,s,
H,73,3.83,s,
H,74,3.83,s,
H,75,3.72,s,
H,76,3.72,s,
H,77,3.72,s,
H,78,2.59,ddd,"15.4,8.2,1.2"
H,79,2.59,ddd,"15.4,11.9,8.5"
H,80,2.78,ddd,"12.4,8.5,1.2"
H,81,2.78,ddd,"12.4,11.9,8.2"
H,82,2.55,s,
H,83,2.55,s,
H,84,2.55,s,
H,85,7.06,ddd,"7.2,1.9,0.5"
H,86,7.22,ddd,"7.2,1.9,0.5"
H,87,2.54,s,
H,88,2.54,s,
H,89,2.54,s,
H,90,2.78,ddd,"12.4,10.5,7.7"
H,91,2.78,ddd,"12.4,10.7,1.8"
H,92,2.85,ddd,"15.4,10.5,1.8"
H,93,2.85,ddd,"15.4,10.7,7.7"
