C,1,21.01,s,
C,2,169.84,s,
O,3,,,
O,4,,,
C,5,79.25,s,
C,6,51.89,s,
C,7,37.71,s,
C,8,92.55,s,
O,9,,,
C,10,81.82,s,
C,11,25.61,s,
C,12,25.61,s,
C,13,40.01,s,
C,14,15.9,s,
C,15,31.05,s,
C,16,70.28,s,
O,17,,,
C,18,170.6,s,
C,19,21.3,s,
O,20,,,
C,21,71.98,s,
O,22,,,
C,23,169.39,s,
C,24,20.42,s,
O,25,,,
C,26,57.93,s,
C,27,65.36,s,
O,28,,,
C,29,165.31,s,
O,30,,,
C,31,127.85,s,
C,32,139.14,s,
C,33,123.99,s,
C,34,153.57,s,
N,35,,,
C,36,150.97,s,
C,37,72.7,s,
O,38,,,
C,39,164.75,s,
O,40,,,
C,41,126.25,s,
C,42,137.32,s,
C,43,123.64,s,
C,44,153.57,s,
N,45,,,
C,46,150.9,s,
H,47,2.03,s,
H,48,2.03,s,
H,49,2.03,s,
H,50,5.68,dd,"8.0,3.4"
H,51,2.4,ddd,"4.2,3.4,1.4"
H,52,1.58,dd,"12.4,4.2"
H,53,1.58,dd,"12.4,1.4"
H,54,1.39,s,
H,55,1.39,s,
H,56,1.39,s,
H,57,1.39,s,
H,58,1.39,s,
H,59,1.39,s,
H,60,2.09,ddq,"10.0,8.5,6.6"
H,61,0.88,d,6.6
H,62,0.88,d,6.6
H,63,0.88,d,6.6
H,64,2.33,ddd,"12.4,10.0,2.8"
H,65,2.33,ddd,"12.4,11.5,8.5"
H,66,5.92,ddd,"11.5,2.8,0.8"
H,67,2.02,s,
H,68,2.02,s,
H,69,2.02,s,
H,70,5.98,d,0.8
H,71,2.0,s,
H,72,2.0,s,
H,73,2.0,s,
H,74,5.02,s,
H,75,5.02,s,
H,76,8.31,ddd,"6.8,1.9,1.4"
H,77,7.48,ddd,"6.8,4.4,0.5"
H,78,8.78,dd,"4.4,1.4"
H,79,9.2,dd,"1.9,0.5"
H,80,5.7,d,8.0
H,81,8.57,ddd,"7.2,1.9,1.4"
H,82,7.48,ddd,"7.2,4.4,0.5"
H,83,8.78,dd,"4.4,1.4"
H,84,9.55,dd,"1.9,0.5"
