C,1,60.7,s,
O,2,,,
C,3,149.17,s,
C,4,109.36,s,
C,5,40.4,s,
C,6,48.95,s,
C,7,29.33,s,
C,8,52.3,s,
N,9,,,
C,10,42.74,s,
C,11,62.1,s,
C,12,35.29,s,
C,13,133.13,s,
C,14,121.77,s,
C,15,111.61,s,
C,16,150.0,s,
O,17,,,
C,18,56.0,s,
C,19,147.0,s,
C,20,110.67,s,
O,21,,,
C,22,155.6,s,
C,23,116.7,s,
C,24,124.1,s,
C,25,132.34,s,
C,26,124.1,s,
C,27,116.7,s,
C,28,39.3,s,
C,29,59.05,s,
C,30,125.15,s,
C,31,125.03,s,
C,32,149.4,s,
O,33,,,
C,34,60.7,s,
C,35,137.38,s,
C,36,137.25,s,
C,37,145.43,s,
O,38,,,
C,39,157.83,s,
C,40,157.83,s,
O,41,,,
C,42,57.75,s,
O,43,,,
C,44,101.48,s,
O,45,,,
C,46,23.0,s,
C,47,50.18,s,
N,48,,,
C,49,42.23,s,
H,50,3.74,s,
H,51,3.74,s,
H,52,3.74,s,
H,53,6.02,d,3.4
H,54,2.83,ddd,"12.9,7.1,3.4"
H,55,2.83,ddd,"12.9,11.2,4.5"
H,56,1.8,m,
H,57,1.8,m,
H,58,3.34,ddd,"12.4,12.2,4.2"
H,59,3.34,ddd,"12.4,5.8,2.4"
H,60,2.35,s,
H,61,2.35,s,
H,62,2.35,s,
H,63,3.6,ddd,"13.1,7.1,2.9"
H,64,3.01,dd,"15.4,13.1"
H,65,3.01,dd,"15.4,2.9"
H,66,6.59,dd,"8.4,1.9"
H,67,6.82,dd,"8.4,0.5"
H,68,3.85,s,
H,69,3.85,s,
H,70,3.85,s,
H,71,4.49,dd,"1.9,0.5"
H,72,7.09,ddd,"26.2,1.9,0.5"
H,73,7.22,ddd,"26.2,1.9,0.5"
H,74,7.22,ddd,"24.5,1.9,0.5"
H,75,7.09,ddd,"24.5,1.9,0.5"
H,76,4.97,dd,"15.4,4.2"
H,77,4.97,dd,"15.4,7.0"
H,78,4.39,dd,"7.0,4.2"
H,79,3.84,s,
H,80,3.84,s,
H,81,3.84,s,
H,82,3.74,s,
H,83,3.74,s,
H,84,3.74,s,
H,85,5.99,s,
H,86,5.99,s,
H,87,2.59,ddd,"15.4,9.5,8.1"
H,88,2.59,ddd,"15.4,9.2,0.6"
H,89,2.78,ddd,"12.4,8.1,0.6"
H,90,2.78,ddd,"12.4,9.5,9.2"
H,91,2.53,s,
H,92,2.53,s,
H,93,2.53,s,
