C,1,55.99,s,
O,2,,,
C,3,145.52,s,
C,4,110.6,s,
C,5,124.7,s,
C,6,128.85,s,
C,7,113.4,s,
C,8,143.4,s,
O,9,,,
C,10,64.8,s,
C,11,36.5,s,
C,12,123.9,s,
C,13,113.6,s,
C,14,144.8,s,
O,15,,,
C,16,56.99,s,
C,17,147.3,s,
O,18,,,
C,19,56.2,s,
C,20,105.1,s,
C,21,148.4,s,
O,22,,,
C,23,147.0,s,
C,24,110.47,s,
C,25,129.35,s,
C,26,124.35,s,
C,27,111.2,s,
C,28,148.26,s,
O,29,,,
C,30,56.0,s,
C,31,126.4,s,
C,32,144.0,s,
O,33,,,
C,34,59.75,s,
C,35,151.4,s,
O,36,,,
C,37,55.67,s,
C,38,110.6,s,
C,39,127.0,s,
C,40,126.2,s,
C,41,62.1,s,
C,42,34.6,s,
N,43,,,
C,44,43.75,s,
C,45,53.03,s,
C,46,28.95,s,
N,47,,,
C,48,42.33,s,
C,49,47.07,s,
C,50,24.4,s,
H,51,3.86,s,
H,52,3.86,s,
H,53,3.86,s,
H,54,6.65,d,0.5
H,55,6.69,d,0.5
H,56,,,
H,57,4.39,t,6.2
H,58,3.01,d,6.2
H,59,3.01,d,6.2
H,60,6.68,d,0.5
H,61,3.8,s,
H,62,3.8,s,
H,63,3.8,s,
H,64,3.84,s,
H,65,3.84,s,
H,66,3.84,s,
H,67,6.73,d,0.5
H,68,6.68,d,0.5
H,69,7.96,d,0.5
H,70,3.8,s,
H,71,3.8,s,
H,72,3.8,s,
H,73,3.78,s,
H,74,3.78,s,
H,75,3.78,s,
H,76,3.81,s,
H,77,3.81,s,
H,78,3.81,s,
H,79,6.73,s,
H,80,2.97,dd,"13.2,3.4"
H,81,2.76,dd,"15.4,3.4"
H,82,2.76,dd,"15.4,13.2"
H,83,2.55,s,
H,84,2.55,s,
H,85,2.55,s,
H,86,2.78,ddd,"12.8,12.4,4.7"
H,87,2.78,ddd,"12.4,5.2,2.5"
H,88,2.96,ddd,"15.4,12.8,5.2"
H,89,2.96,ddd,"15.4,4.7,2.5"
H,90,2.54,s,
H,91,2.54,s,
H,92,2.54,s,
H,93,2.78,ddd,"12.5,12.4,5.5"
H,94,2.78,ddd,"12.4,5.3,2.5"
H,95,2.85,ddd,"15.4,12.5,5.3"
H,96,2.85,ddd,"15.4,5.5,2.5"
