C,1,56.99,s,
O,2,,,
C,3,144.8,s,
C,4,113.6,s,
C,5,123.9,s,
C,6,36.5,s,
C,7,64.8,s,
C,8,129.88,s,
C,9,110.81,s,
C,10,146.69,s,
O,11,,,
C,12,55.78,s,
C,13,147.21,s,
O,14,,,
C,15,55.95,s,
C,16,112.24,s,
C,17,126.03,s,
C,18,25.52,s,
C,19,47.07,s,
N,20,,,
C,21,42.33,s,
C,22,148.4,s,
O,23,,,
C,24,147.0,s,
C,25,110.47,s,
C,26,129.35,s,
C,27,124.35,s,
C,28,111.2,s,
C,29,148.26,s,
O,30,,,
C,31,56.0,s,
C,32,121.19,s,
C,33,143.95,s,
O,34,,,
C,35,146.53,s,
O,36,,,
C,37,56.29,s,
C,38,110.7,s,
C,39,127.53,s,
C,40,125.36,s,
C,41,62.33,s,
C,42,34.6,s,
N,43,,,
C,44,43.75,s,
C,45,53.03,s,
C,46,29.13,s,
C,47,105.1,s,
C,48,147.3,s,
O,49,,,
C,50,56.2,s,
H,51,3.8,s,
H,52,3.8,s,
H,53,3.8,s,
H,54,6.68,d,0.5
H,55,3.01,d,6.2
H,56,3.01,d,6.2
H,57,4.39,t,6.2
H,58,6.61,s,
H,59,3.8,s,
H,60,3.8,s,
H,61,3.8,s,
H,62,3.8,s,
H,63,3.8,s,
H,64,3.8,s,
H,65,6.61,s,
H,66,2.85,ddd,"15.4,11.3,5.2"
H,67,2.85,ddd,"15.4,11.4,4.1"
H,68,2.78,ddd,"12.4,11.4,5.2"
H,69,2.78,ddd,"12.4,11.3,4.1"
H,70,2.54,s,
H,71,2.54,s,
H,72,2.54,s,
H,73,6.68,d,0.5
H,74,7.96,d,0.5
H,75,3.8,s,
H,76,3.8,s,
H,77,3.8,s,
H,78,,,
H,79,3.93,s,
H,80,3.93,s,
H,81,3.93,s,
H,82,6.71,s,
H,83,2.97,dd,"10.2,2.8"
H,84,2.76,dd,"15.4,2.8"
H,85,2.76,dd,"15.4,10.2"
H,86,2.55,s,
H,87,2.55,s,
H,88,2.55,s,
H,89,2.78,ddd,"12.4,10.8,8.8"
H,90,2.78,ddd,"12.4,9.8,0.4"
H,91,2.96,ddd,"15.4,8.8,0.4"
H,92,2.96,ddd,"15.4,10.8,9.8"
H,93,6.73,d,0.5
H,94,3.84,s,
H,95,3.84,s,
H,96,3.84,s,
