C,1,60.95,s,
O,2,,,
C,3,152.48,s,
C,4,108.29,s,
C,5,138.21,s,
C,6,113.16,s,
C,7,154.6,s,
O,8,,,
C,9,118.5,s,
C,10,137.16,s,
C,11,128.23,s,
C,12,125.61,s,
C,13,125.61,s,
C,14,128.23,s,
C,15,137.16,s,
C,16,118.91,s,
C,17,164.12,s,
O,18,,,
C,19,100.69,s,
C,20,158.73,s,
O,21,,,
C,22,125.15,s,
C,23,130.6,s,
C,24,35.29,s,
C,25,43.65,s,
C,26,20.71,s,
N,27,,,
C,28,48.53,s,
C,29,19.44,s,
C,30,132.55,s,
C,31,115.27,s,
C,32,136.14,s,
C,33,21.88,s,
C,34,107.27,s,
C,35,157.5,s,
O,36,,,
C,37,56.3,s,
C,38,108.05,s,
C,39,160.03,s,
O,40,,,
C,41,160.03,s,
O,42,,,
C,43,108.05,s,
C,44,157.5,s,
O,45,,,
C,46,56.3,s,
C,47,107.27,s,
C,48,136.14,s,
C,49,21.88,s,
C,50,115.27,s,
C,51,132.55,s,
C,52,35.29,s,
C,53,47.69,s,
C,54,17.36,s,
N,55,,,
C,56,173.53,s,
C,57,24.18,s,
H,58,3.71,s,
H,59,3.71,s,
H,60,3.71,s,
H,61,6.35,s,
H,62,,,
H,63,7.06,t,0.5
H,64,7.06,t,0.5
H,65,,,
H,66,6.47,s,
H,67,,,
H,68,3.01,dd,"15.4,7.9"
H,69,3.01,dd,"15.4,8.2"
H,70,3.62,ddq,"8.2,7.9,6.2"
H,71,1.29,d,6.2
H,72,1.29,d,6.2
H,73,1.29,d,6.2
H,74,,,
H,75,5.63,q,6.4
H,76,1.58,d,6.4
H,77,1.58,d,6.4
H,78,1.58,d,6.4
H,79,7.86,dd,"1.9,0.5"
H,80,2.52,s,
H,81,2.52,s,
H,82,2.52,s,
H,83,6.43,d,1.9
H,84,4.02,s,
H,85,4.02,s,
H,86,4.02,s,
H,87,,,
H,88,,,
H,89,4.02,s,
H,90,4.02,s,
H,91,4.02,s,
H,92,6.43,d,1.9
H,93,2.52,s,
H,94,2.52,s,
H,95,2.52,s,
H,96,7.86,dd,"1.9,0.5"
H,97,3.01,dd,"15.4,9.9"
H,98,3.01,dd,"15.4,6.3"
H,99,4.28,ddq,"9.9,6.3,6.2"
H,100,1.29,d,6.2
H,101,1.29,d,6.2
H,102,1.29,d,6.2
H,103,2.26,s,
H,104,2.26,s,
H,105,2.26,s,
