C,1,15.38,s,
C,2,138.77,s,
C,3,127.94,s,
C,4,18.39,s,
C,5,167.98,s,
O,6,,,
O,7,,,
C,8,71.31,s,
C,9,77.48,s,
O,10,,,
C,11,40.4,s,
C,12,30.5,s,
C,13,27.2,s,
C,14,41.86,s,
C,15,23.79,s,
C,16,52.87,s,
C,17,33.14,s,
C,18,149.8,s,
C,19,124.78,s,
C,20,9.36,s,
C,21,166.77,s,
O,22,,,
O,23,,,
C,24,77.48,s,
C,25,40.4,s,
C,26,158.51,s,
C,27,141.77,s,
C,28,33.14,s,
C,29,52.87,s,
C,30,27.75,s,
C,31,16.7,s,
C,32,27.2,s,
C,33,41.86,s,
C,34,23.79,s,
C,35,76.78,s,
O,36,,,
C,37,197.18,s,
O,38,,,
C,39,140.4,s,
C,40,124.78,s,
C,41,9.36,s,
C,42,166.77,s,
O,43,,,
O,44,,,
C,45,51.95,s,
H,46,1.9,d,7.0
H,47,1.9,d,7.0
H,48,1.9,d,7.0
H,49,6.72,q,7.0
H,50,1.87,s,
H,51,1.87,s,
H,52,1.87,s,
H,53,4.31,s,
H,54,4.31,s,
H,55,,,
H,56,2.99,ddd,"9.7,8.3,4.3"
H,57,2.05,ddd,"7.7,4.3,2.4"
H,58,2.05,ddd,"9.7,9.5,2.4"
H,59,1.5,ddd,"9.5,8.3,7.7"
H,60,1.13,s,
H,61,1.13,s,
H,62,1.13,s,
H,63,2.29,dd,"10.7,1.9"
H,64,2.44,dd,"15.4,10.7"
H,65,2.44,dd,"15.4,1.9"
H,66,1.77,s,
H,67,1.77,s,
H,68,1.77,s,
H,69,2.83,s,
H,70,2.44,dd,"15.4,1.9"
H,71,2.44,dd,"15.4,13.4"
H,72,2.29,dd,"13.4,1.9"
H,73,2.03,ddd,"9.2,8.2,5.5"
H,74,0.87,ddd,"8.5,5.5,2.4"
H,75,0.87,ddd,"9.3,9.2,2.4"
H,76,1.5,ddd,"9.3,8.5,8.2"
H,77,1.13,s,
H,78,1.13,s,
H,79,1.13,s,
H,80,4.41,s,
H,81,,,
H,82,1.87,s,
H,83,1.87,s,
H,84,1.87,s,
H,85,3.73,s,
H,86,3.73,s,
H,87,3.73,s,
