C,1,56.0,s,
O,2,,,
C,3,148.26,s,
C,4,111.2,s,
C,5,124.35,s,
C,6,129.35,s,
C,7,110.47,s,
C,8,147.0,s,
O,9,,,
C,10,137.25,s,
C,11,155.33,s,
O,12,,,
C,13,56.73,s,
C,14,107.15,s,
C,15,129.3,s,
C,16,124.41,s,
C,17,36.5,s,
C,18,64.8,s,
C,19,131.87,s,
C,20,110.33,s,
C,21,151.83,s,
O,22,,,
C,23,56.31,s,
C,24,135.77,s,
O,25,,,
C,26,60.52,s,
C,27,147.5,s,
O,28,,,
C,29,125.03,s,
C,30,23.0,s,
C,31,50.18,s,
N,32,,,
C,33,42.33,s,
C,34,151.92,s,
O,35,,,
C,36,55.99,s,
C,37,34.6,s,
C,38,62.2,s,
C,39,127.11,s,
C,40,125.03,s,
C,41,149.4,s,
O,42,,,
C,43,60.7,s,
C,44,137.25,s,
O,45,,,
C,46,60.93,s,
C,47,145.31,s,
O,48,,,
C,49,60.33,s,
C,50,124.28,s,
C,51,23.0,s,
C,52,50.18,s,
N,53,,,
C,54,43.72,s,
H,55,3.8,s,
H,56,3.8,s,
H,57,3.8,s,
H,58,7.96,d,0.5
H,59,6.68,d,0.5
H,60,3.86,s,
H,61,3.86,s,
H,62,3.86,s,
H,63,6.6,d,6.5
H,64,6.9,d,6.5
H,65,3.01,d,6.2
H,66,3.01,d,6.2
H,67,4.39,t,6.2
H,68,6.64,s,
H,69,3.87,s,
H,70,3.87,s,
H,71,3.87,s,
H,72,3.88,s,
H,73,3.88,s,
H,74,3.88,s,
H,75,,,
H,76,2.59,ddd,"15.4,10.4,6.3"
H,77,2.59,ddd,"15.4,10.8,1.5"
H,78,2.78,ddd,"12.4,10.4,1.5"
H,79,2.78,ddd,"12.4,10.8,6.3"
H,80,2.54,s,
H,81,2.54,s,
H,82,2.54,s,
H,83,3.84,s,
H,84,3.84,s,
H,85,3.84,s,
H,86,2.76,dd,"15.4,3.3"
H,87,2.76,dd,"15.4,12.7"
H,88,2.97,dd,"12.7,3.3"
H,89,3.84,s,
H,90,3.84,s,
H,91,3.84,s,
H,92,3.83,s,
H,93,3.83,s,
H,94,3.83,s,
H,95,3.72,s,
H,96,3.72,s,
H,97,3.72,s,
H,98,2.59,ddd,"15.4,10.5,8.1"
H,99,2.59,ddd,"15.4,8.0,1.6"
H,100,2.78,ddd,"12.4,10.5,8.0"
H,101,2.78,ddd,"12.4,8.1,1.6"
H,102,2.55,s,
H,103,2.55,s,
H,104,2.55,s,
