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,18,125.03,s,
C,19,128.7,s,
C,20,109.89,s,
C,21,151.83,s,
O,22,,,
C,23,56.31,s,
C,24,139.54,s,
O,25,,,
C,26,60.99,s,
C,27,124.28,s,
C,28,144.3,s,
O,29,,,
C,30,59.75,s,
C,31,151.4,s,
O,32,,,
C,33,55.67,s,
C,34,110.6,s,
C,35,127.0,s,
C,36,126.68,s,
C,37,62.2,s,
C,38,35.29,s,
N,39,,,
C,40,43.72,s,
C,41,52.96,s,
C,42,28.95,s,
C,43,120.41,s,
C,44,124.1,s,
N,45,,,
C,46,42.39,s,
C,47,47.8,s,
C,48,24.4,s,
H,49,3.86,s,
H,50,3.86,s,
H,51,3.86,s,
H,52,6.65,d,0.5
H,53,6.69,d,0.5
H,54,,,
H,55,4.39,t,6.2
H,56,3.66,d,6.2
H,57,3.66,d,6.2
H,58,7.22,ddd,"6.7,1.9,0.5"
H,59,7.06,ddd,"6.7,1.9,0.5"
H,60,7.34,s,
H,61,3.87,s,
H,62,3.87,s,
H,63,3.87,s,
H,64,3.81,s,
H,65,3.81,s,
H,66,3.81,s,
H,67,3.78,s,
H,68,3.78,s,
H,69,3.78,s,
H,70,3.81,s,
H,71,3.81,s,
H,72,3.81,s,
H,73,6.73,s,
H,74,2.97,dd,"10.3,1.9"
H,75,3.01,dd,"15.4,1.9"
H,76,3.01,dd,"15.4,10.3"
H,77,2.55,s,
H,78,2.55,s,
H,79,2.55,s,
H,80,2.78,ddd,"12.4,11.4,8.0"
H,81,2.78,ddd,"12.4,8.5,0.6"
H,82,2.96,ddd,"15.4,11.4,8.5"
H,83,2.96,ddd,"15.4,8.0,0.6"
H,84,7.06,ddd,"7.4,1.9,0.5"
H,85,7.22,ddd,"7.4,1.9,0.5"
H,86,2.54,s,
H,87,2.54,s,
H,88,2.54,s,
H,89,2.78,ddd,"12.4,11.1,1.6"
H,90,2.78,ddd,"12.4,10.7,6.6"
H,91,2.85,ddd,"15.4,10.7,1.6"
H,92,2.85,ddd,"15.4,11.1,6.6"
