C,1,56.02,s,
O,2,,,
C,3,147.71,s,
C,4,110.33,s,
C,5,129.88,s,
C,6,124.05,s,
C,7,114.6,s,
C,8,145.64,s,
O,9,,,
C,10,24.2,s,
C,11,46.9,s,
N,12,,,
C,13,42.39,s,
C,14,64.7,s,
C,15,39.1,s,
C,16,134.0,s,
C,17,130.5,s,
C,18,122.0,s,
C,19,153.95,s,
O,20,,,
C,21,145.4,s,
C,22,132.4,s,
C,23,127.97,s,
C,24,40.4,s,
C,25,65.5,s,
C,26,130.6,s,
C,27,110.65,s,
C,28,146.69,s,
O,29,,,
C,30,55.78,s,
C,31,147.21,s,
O,32,,,
C,33,55.95,s,
C,34,112.24,s,
C,35,125.8,s,
C,36,25.52,s,
C,37,46.63,s,
N,38,,,
C,39,42.27,s,
C,40,115.8,s,
C,41,110.2,s,
C,42,147.49,s,
O,43,,,
C,44,122.0,s,
C,45,130.5,s,
H,46,3.86,s,
H,47,3.86,s,
H,48,3.86,s,
H,49,6.64,d,0.5
H,50,6.63,d,0.5
H,51,,,
H,52,2.85,ddd,"15.4,11.1,5.5"
H,53,2.85,ddd,"15.4,10.9,2.1"
H,54,2.78,ddd,"12.4,11.1,2.1"
H,55,2.78,ddd,"12.4,10.9,5.5"
H,56,2.54,s,
H,57,2.54,s,
H,58,2.54,s,
H,59,4.39,t,6.2
H,60,3.66,d,6.2
H,61,3.66,d,6.2
H,62,7.22,ddd,"6.9,1.9,0.5"
H,63,7.09,ddd,"6.9,1.9,0.5"
H,64,4.74,dd,"1.9,0.5"
H,65,3.01,d,6.2
H,66,3.01,d,6.2
H,67,4.39,t,6.2
H,68,6.61,s,
H,69,3.8,s,
H,70,3.8,s,
H,71,3.8,s,
H,72,3.8,s,
H,73,3.8,s,
H,74,3.8,s,
H,75,6.61,s,
H,76,2.85,ddd,"15.4,13.5,4.8"
H,77,2.85,ddd,"15.4,3.2,2.1"
H,78,2.78,ddd,"12.4,4.8,2.1"
H,79,2.78,ddd,"13.5,12.4,3.2"
H,80,2.54,s,
H,81,2.54,s,
H,82,2.54,s,
H,83,6.52,dd,"6.4,1.9"
H,84,6.78,dd,"6.4,0.5"
H,85,,,
H,86,7.09,ddd,"8.4,1.9,0.5"
H,87,7.22,ddd,"8.4,1.9,0.5"
