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,13,37.89,s,
C,14,18.22,s,
C,15,28.6,s,
C,16,22.2,s,
C,17,73.6,s,
O,18,,,
C,19,176.5,s,
O,20,,,
C,21,40.5,s,
C,22,18.65,s,
C,23,18.65,s,
C,24,41.86,s,
C,25,72.44,s,
O,26,,,
C,27,165.31,s,
O,28,,,
C,29,127.85,s,
C,30,139.14,s,
C,31,123.99,s,
C,32,153.57,s,
N,33,,,
C,34,150.97,s,
C,35,72.7,s,
O,36,,,
C,37,165.7,s,
O,38,,,
C,39,133.4,s,
C,40,129.51,s,
C,41,128.88,s,
C,42,133.32,s,
C,43,128.88,s,
C,44,129.51,s,
H,45,2.03,s,
H,46,2.03,s,
H,47,2.03,s,
H,48,5.68,dd,"2.8,2.6"
H,49,2.4,ddd,"3.6,2.6,1.5"
H,50,1.58,dd,"12.4,1.5"
H,51,1.58,dd,"12.4,3.6"
H,52,1.39,s,
H,53,1.39,s,
H,54,1.39,s,
H,55,1.39,s,
H,56,1.39,s,
H,57,1.39,s,
H,58,1.93,dqd,"10.5,6.6,1.8"
H,59,1.17,d,6.6
H,60,1.17,d,6.6
H,61,1.17,d,6.6
H,62,1.91,m,
H,63,1.91,m,
H,64,1.96,m,
H,65,1.96,m,
H,66,5.53,dd,"8.5,7.9"
H,67,2.54,m,6.6
H,68,1.14,d,6.6
H,69,1.14,d,6.6
H,70,1.14,d,6.6
H,71,1.14,d,6.6
H,72,1.14,d,6.6
H,73,1.14,d,6.6
H,74,4.99,s,
H,75,4.99,s,
H,76,8.31,ddd,"7.5,1.9,1.4"
H,77,7.48,ddd,"7.5,4.1,0.5"
H,78,8.78,dd,"4.1,1.4"
H,79,9.2,dd,"1.9,0.5"
H,80,6.07,d,2.8
H,81,8.03,m,
H,82,7.46,m,
H,83,7.57,ddt,"8.0,7.4,1.4"
H,84,7.46,m,
H,85,8.03,m,
