C,1,12.72,s,
C,2,118.86,s,
C,3,140.39,s,
C,4,46.86,s,
N,5,,,
C,6,57.09,s,
C,7,35.29,s,
C,8,110.5,s,
C,9,137.8,s,
N,10,,,
C,11,136.0,s,
C,12,109.5,s,
C,13,121.21,s,
C,14,118.7,s,
C,15,117.4,s,
C,16,130.0,s,
C,17,36.8,s,
C,18,128.32,s,
C,19,116.56,s,
C,20,142.9,s,
N,21,,,
C,22,141.9,s,
C,23,110.15,s,
C,24,128.2,s,
C,25,105.31,s,
C,26,156.64,s,
O,27,,,
C,28,55.91,s,
C,29,20.0,s,
C,30,49.3,s,
N,31,,,
C,32,54.5,s,
C,33,36.36,s,
C,34,31.1,s,
C,35,41.6,s,
C,36,28.2,s,
C,37,11.9,s,
C,38,57.0,s,
C,39,33.7,s,
C,40,34.7,s,
C,41,32.61,s,
C,42,42.38,s,
C,43,40.4,s,
C,44,172.96,s,
O,45,,,
O,46,,,
C,47,52.08,s,
H,48,1.67,d,7.0
H,49,1.67,d,7.0
H,50,1.67,d,7.0
H,51,5.45,q,7.0
H,52,4.69,s,
H,53,4.69,s,
H,54,,,
H,55,3.7,ddd,"15.1,7.4,5.0"
H,56,3.01,dd,"15.4,7.4"
H,57,3.01,dd,"15.4,15.1"
H,58,,,
H,59,7.2,ddd,"7.5,1.4,0.5"
H,60,7.18,td,"7.5,1.4"
H,61,7.13,td,"7.5,1.4"
H,62,7.53,ddd,"7.5,1.4,0.5"
H,63,2.83,dd,"9.2,1.5"
H,64,7.48,d,0.5
H,65,,,
H,66,7.45,d,0.5
H,67,3.84,s,
H,68,3.84,s,
H,69,3.84,s,
H,70,3.15,ddd,"16.6,13.4,10.1"
H,71,3.15,ddd,"13.4,9.4,2.9"
H,72,3.34,ddd,"12.4,10.1,2.9"
H,73,3.34,ddd,"16.6,12.4,9.4"
H,74,3.31,dd,"12.4,12.0"
H,75,3.31,dd,"12.4,4.4"
H,76,1.65,m,
H,77,1.66,ddd,"17.4,12.4,4.2"
H,78,1.66,td,"12.4,9.2"
H,79,2.37,m,
H,80,1.44,qd,"7.0,6.0"
H,81,1.44,qd,"7.0,6.0"
H,82,0.88,t,7.0
H,83,0.88,t,7.0
H,84,0.88,t,7.0
H,85,3.85,dd,"13.6,8.0"
H,86,2.83,ddd,"16.4,13.6,9.6"
H,87,1.66,ddd,"16.4,12.4,0.7"
H,88,1.66,ddd,"12.4,9.6,7.5"
H,89,1.66,ddd,"15.2,12.4,1.5"
H,90,1.66,ddd,"12.4,9.2,7.4"
H,91,3.74,ddd,"15.2,13.0,7.4"
H,92,2.74,dd,"13.0,5.0"
H,93,2.47,s,
H,94,2.47,s,
H,95,2.47,s,
