C,1,11.09,s,
S,2,,,
C,3,196.54,s,
O,4,,,
C,5,30.5,s,
C,6,115.28,s,
O,7,,,
C,8,77.06,s,
C,9,39.3,s,
C,10,13.55,s,
C,11,52.93,s,
C,12,27.97,s,
C,13,24.9,s,
C,14,51.8,s,
C,15,38.52,s,
C,16,71.11,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,23,127.67,s,
C,24,155.07,s,
C,25,43.11,s,
C,26,18.51,s,
C,27,50.54,s,
C,28,22.21,s,
C,29,40.8,s,
C,30,43.9,s,
C,31,12.8,s,
C,32,40.59,s,
C,33,77.48,s,
C,34,25.81,s,
O,35,,,
C,36,81.5,s,
C,37,23.3,s,
C,38,23.3,s,
O,39,,,
H,40,2.43,s,
H,41,2.43,s,
H,42,2.43,s,
H,43,2.05,s,
H,44,2.05,s,
H,45,4.88,ddd,"9.8,5.3,5.0"
H,46,2.11,qdd,"6.6,5.6,5.0"
H,47,1.05,d,6.6
H,48,1.05,d,6.6
H,49,1.05,d,6.6
H,50,1.58,ddd,"11.9,9.0,5.6"
H,51,1.62,m,
H,52,1.62,m,
H,53,1.48,m,
H,54,1.48,m,
H,55,1.61,ddd,"11.7,4.8,3.7"
H,56,2.4,ddd,"10.0,5.9,4.8"
H,57,4.19,ddd,"10.0,9.7,7.6"
H,58,,,
H,59,2.52,dd,"15.4,7.6"
H,60,2.52,dd,"15.4,9.7"
H,61,6.08,s,
H,62,6.15,d,12.0
H,63,7.41,d,12.0
H,64,1.2,s,
H,65,1.2,s,
H,66,1.2,s,
H,67,1.61,ddd,"11.9,5.9,5.2"
H,68,1.5,m,
H,69,1.5,m,
H,70,1.77,ddd,"13.9,12.4,4.4"
H,71,1.77,ddd,"12.4,3.8,3.6"
H,72,0.68,s,
H,73,0.68,s,
H,74,0.68,s,
H,75,2.27,dd,"12.4,5.3"
H,76,2.27,dd,"12.4,9.8"
H,77,1.4,s,
H,78,1.4,s,
H,79,1.4,s,
H,80,2.05,s,
H,81,2.05,s,
H,82,2.05,s,
H,83,2.05,s,
H,84,2.05,s,
H,85,2.05,s,
