C,1,18.37,s,
C,2,31.44,s,
C,3,18.37,s,
C,4,73.63,s,
O,5,,,
S,6,,,
O,7,,,
O,8,,,
O,9,,,
C,10,53.84,s,
N,11,,,
C,12,69.15,s,
O,13,,,
C,14,74.13,s,
C,15,28.55,s,
C,16,27.95,s,
C,17,35.8,s,
C,18,16.5,s,
C,19,38.6,s,
C,20,20.37,s,
C,21,35.28,s,
C,22,41.86,s,
C,23,180.49,s,
O,24,,,
O,25,,,
C,26,143.15,s,
C,27,125.0,s,
C,28,65.1,s,
O,29,,,
C,30,61.3,s,
O,31,,,
C,32,67.7,s,
C,33,40.59,s,
C,34,25.36,s,
C,35,26.83,s,
C,36,50.54,s,
C,37,40.62,s,
C,38,20.26,s,
C,39,133.93,s,
C,40,134.37,s,
C,41,43.06,s,
C,42,17.66,s,
C,43,33.36,s,
C,44,20.0,s,
C,45,20.0,s,
H,46,0.94,d,6.4
H,47,0.94,d,6.4
H,48,0.94,d,6.4
H,49,1.87,m,"6.4,5.0"
H,50,0.94,d,6.4
H,51,0.94,d,6.4
H,52,0.94,d,6.4
H,53,4.52,t,5.0
H,54,,,
H,55,2.7,td,"5.7,5.0"
H,56,,,
H,57,,,
H,58,3.82,d,5.7
H,59,3.82,d,5.7
H,60,4.83,m,
H,61,1.7,m,
H,62,1.7,m,
H,63,1.72,ddd,"12.4,8.7,1.6"
H,64,1.72,ddd,"12.4,10.0,8.3"
H,65,1.05,s,
H,66,1.05,s,
H,67,1.05,s,
H,68,2.94,dd,"12.4,3.2"
H,69,1.71,dtd,"13.9,12.4,4.9"
H,70,1.71,m,
H,71,1.72,ddd,"12.4,4.9,3.3"
H,72,1.72,ddd,"13.9,12.4,6.8"
H,73,,,
H,74,4.6,d,1.8
H,75,,,
H,76,3.36,d,1.8
H,77,2.27,dd,"12.4,11.5"
H,78,2.27,dd,"12.4,3.9"
H,79,2.37,ddd,"12.4,10.4,6.2"
H,80,2.37,ddd,"12.4,11.8,1.1"
H,81,1.58,m,
H,82,1.58,m,
H,83,1.61,ddd,"9.6,8.1,5.9"
H,84,2.33,dqd,"7.0,6.8,5.9"
H,85,0.89,d,6.8
H,86,0.89,d,6.8
H,87,0.89,d,6.8
H,88,5.12,dd,"15.0,7.0"
H,89,5.2,dd,"15.0,7.0"
H,90,2.33,dqd,"7.0,6.8,5.5"
H,91,0.89,d,6.8
H,92,0.89,d,6.8
H,93,0.89,d,6.8
H,94,1.87,m,"6.4,5.5"
H,95,0.81,d,6.4
H,96,0.81,d,6.4
H,97,0.81,d,6.4
H,98,0.81,d,6.4
H,99,0.81,d,6.4
H,100,0.81,d,6.4
