C,1,7.23,s,
C,2,24.01,s,
C,3,115.28,s,
O,4,,,
C,5,77.06,s,
C,6,39.3,s,
C,7,13.55,s,
C,8,50.54,s,
C,9,26.26,s,
C,10,23.76,s,
C,11,45.54,s,
C,12,44.75,s,
C,13,77.06,s,
O,14,,,
C,15,170.21,s,
C,16,21.23,s,
O,17,,,
C,18,39.37,s,
C,19,153.63,s,
C,20,125.23,s,
C,21,185.79,s,
O,22,,,
C,23,126.6,s,
C,24,159.1,s,
C,25,44.4,s,
C,26,18.8,s,
C,27,54.73,s,
C,28,74.22,s,
O,29,,,
C,30,76.9,s,
O,31,,,
C,32,169.89,s,
C,33,20.79,s,
O,34,,,
C,35,46.83,s,
C,36,12.67,s,
C,37,40.59,s,
C,38,77.48,s,
C,39,25.81,s,
O,40,,,
C,41,81.5,s,
C,42,23.3,s,
C,43,23.3,s,
O,44,,,
H,45,0.88,t,7.1
H,46,0.88,t,7.1
H,47,0.88,t,7.1
H,48,1.76,q,7.1
H,49,1.76,q,7.1
H,50,4.88,ddd,"9.8,5.0,1.5"
H,51,2.11,qdd,"6.6,5.6,5.0"
H,52,1.05,d,6.6
H,53,1.05,d,6.6
H,54,1.05,d,6.6
H,55,1.61,ddd,"11.1,7.2,5.6"
H,56,1.48,m,
H,57,1.48,m,
H,58,1.45,m,
H,59,1.45,m,
H,60,1.94,ddd,"11.0,6.4,1.2"
H,61,2.47,ddd,"11.0,7.2,3.3"
H,62,4.88,ddd,"10.1,9.0,3.3"
H,63,2.02,s,
H,64,2.02,s,
H,65,2.02,s,
H,66,2.52,dd,"15.4,10.1"
H,67,2.52,dd,"15.4,9.0"
H,68,6.08,s,
H,69,6.15,d,12.0
H,70,7.41,d,12.0
H,71,1.31,s,
H,72,1.31,s,
H,73,1.31,s,
H,74,1.86,dd,"7.2,5.0"
H,75,4.19,dd,"8.8,5.0"
H,76,,,
H,77,4.77,d,8.8
H,78,2.0,s,
H,79,2.0,s,
H,80,2.0,s,
H,81,0.72,s,
H,82,0.72,s,
H,83,0.72,s,
H,84,2.27,dd,"12.4,9.8"
H,85,2.27,dd,"12.4,1.5"
H,86,1.4,s,
H,87,1.4,s,
H,88,1.4,s,
H,89,2.05,s,
H,90,2.05,s,
H,91,2.05,s,
H,92,2.05,s,
H,93,2.05,s,
H,94,2.05,s,
