C,1,56.31,s,
O,2,,,
C,3,151.83,s,
C,4,110.33,s,
C,5,131.87,s,
C,6,125.03,s,
C,7,149.4,s,
O,8,,,
C,9,60.7,s,
C,10,139.54,s,
O,11,,,
C,12,60.99,s,
C,13,23.0,s,
C,14,50.18,s,
N,15,,,
C,16,42.33,s,
C,17,64.8,s,
C,18,36.5,s,
C,19,124.41,s,
C,20,114.49,s,
C,21,148.66,s,
O,22,,,
C,23,154.85,s,
C,24,120.98,s,
C,25,130.5,s,
C,26,134.0,s,
C,27,39.73,s,
C,28,64.8,s,
C,29,131.87,s,
C,30,110.33,s,
C,31,151.83,s,
O,32,,,
C,33,56.31,s,
C,34,137.25,s,
C,35,145.43,s,
C,36,125.03,s,
C,37,23.0,s,
C,38,50.18,s,
N,39,,,
C,40,42.33,s,
O,41,,,
C,42,98.83,s,
O,43,,,
C,44,130.5,s,
C,45,120.98,s,
C,46,137.38,s,
O,47,,,
C,48,60.87,s,
C,49,142.1,s,
O,50,,,
C,51,61.43,s,
C,52,151.92,s,
O,53,,,
C,54,55.99,s,
H,55,3.87,s,
H,56,3.87,s,
H,57,3.87,s,
H,58,6.64,s,
H,59,3.84,s,
H,60,3.84,s,
H,61,3.84,s,
H,62,3.81,s,
H,63,3.81,s,
H,64,3.81,s,
H,65,2.59,ddd,"15.4,11.4,5.1"
H,66,2.59,ddd,"15.4,10.9,3.0"
H,67,2.78,ddd,"12.4,10.9,5.1"
H,68,2.78,ddd,"12.4,11.4,3.0"
H,69,2.54,s,
H,70,2.54,s,
H,71,2.54,s,
H,72,4.39,t,6.2
H,73,3.01,d,6.2
H,74,3.01,d,6.2
H,75,6.68,s,
H,76,7.09,ddd,"7.6,1.9,0.5"
H,77,7.22,ddd,"7.6,1.9,0.5"
H,78,3.66,d,6.2
H,79,3.66,d,6.2
H,80,4.39,t,6.2
H,81,6.64,s,
H,82,3.87,s,
H,83,3.87,s,
H,84,3.87,s,
H,85,2.59,ddd,"15.4,10.8,1.8"
H,86,2.59,ddd,"15.4,11.0,7.3"
H,87,2.78,ddd,"12.4,10.8,7.3"
H,88,2.78,ddd,"12.4,11.0,1.8"
H,89,2.54,s,
H,90,2.54,s,
H,91,2.54,s,
H,92,5.9,s,
H,93,5.9,s,
H,94,7.22,ddd,"6.4,1.9,0.5"
H,95,7.09,ddd,"6.4,1.9,0.5"
H,96,3.86,s,
H,97,3.86,s,
H,98,3.86,s,
H,99,3.83,s,
H,100,3.83,s,
H,101,3.83,s,
H,102,3.84,s,
H,103,3.84,s,
H,104,3.84,s,
