C,1,55.99,s,
O,2,,,
C,3,145.52,s,
C,4,110.6,s,
C,5,124.7,s,
C,6,129.6,s,
C,7,113.4,s,
C,8,143.4,s,
O,9,,,
C,10,64.4,s,
C,11,40.4,s,
C,12,127.97,s,
C,13,115.8,s,
C,14,110.2,s,
C,15,147.49,s,
O,16,,,
C,17,145.4,s,
O,18,,,
C,19,153.95,s,
C,20,122.0,s,
C,21,130.5,s,
C,22,134.0,s,
C,23,39.1,s,
C,24,64.9,s,
C,25,128.54,s,
C,26,111.12,s,
C,27,146.69,s,
O,28,,,
C,29,55.78,s,
C,30,147.21,s,
O,31,,,
C,32,55.95,s,
C,33,112.24,s,
C,34,125.2,s,
C,35,25.52,s,
C,36,47.8,s,
N,37,,,
C,38,42.39,s,
C,39,130.5,s,
C,40,122.0,s,
C,41,132.4,s,
N,42,,,
C,43,42.27,s,
C,44,46.63,s,
C,45,24.4,s,
H,46,3.86,s,
H,47,3.86,s,
H,48,3.86,s,
H,49,6.65,d,0.5
H,50,6.69,d,0.5
H,51,,,
H,52,4.39,t,6.2
H,53,3.01,d,6.2
H,54,3.01,d,6.2
H,55,6.52,dd,"9.4,1.9"
H,56,6.78,dd,"9.4,0.5"
H,57,,,
H,58,7.09,ddd,"7.0,1.9,0.5"
H,59,7.22,ddd,"7.0,1.9,0.5"
H,60,3.66,d,6.2
H,61,3.66,d,6.2
H,62,4.39,t,6.2
H,63,6.61,s,
H,64,3.8,s,
H,65,3.8,s,
H,66,3.8,s,
H,67,3.8,s,
H,68,3.8,s,
H,69,3.8,s,
H,70,6.61,s,
H,71,2.85,ddd,"15.4,10.7,9.5"
H,72,2.85,ddd,"15.4,8.6,1.2"
H,73,2.78,ddd,"12.4,10.7,8.6"
H,74,2.78,ddd,"12.4,9.5,1.2"
H,75,2.54,s,
H,76,2.54,s,
H,77,2.54,s,
H,78,7.22,ddd,"9.3,1.9,0.5"
H,79,7.09,ddd,"9.3,1.9,0.5"
H,80,4.74,dd,"1.9,0.5"
H,81,2.54,s,
H,82,2.54,s,
H,83,2.54,s,
H,84,2.78,ddd,"12.4,9.8,9.1"
H,85,2.78,ddd,"12.4,10.0,0.5"
H,86,2.85,ddd,"15.4,9.1,0.5"
H,87,2.85,ddd,"15.4,10.0,9.8"
