C,1,115.37,s,
C,2,139.7,s,
C,3,36.3,s,
C,4,63.85,s,
C,5,123.84,s,
C,6,127.72,s,
C,7,134.28,s,
C,8,142.35,s,
C,9,93.1,s,
C,10,156.64,s,
O,11,,,
C,12,55.91,s,
N,13,,,
C,14,35.85,s,
C,15,57.53,s,
C,16,56.75,s,
C,17,35.12,s,
C,18,31.9,s,
C,19,146.35,s,
C,20,121.02,s,
C,21,12.97,s,
C,22,52.94,s,
N,23,,,
C,24,51.91,s,
C,25,38.94,s,
C,26,41.86,s,
C,27,51.6,s,
C,28,171.4,s,
O,29,,,
O,30,,,
C,31,51.9,s,
N,32,,,
C,33,142.42,s,
C,34,99.85,s,
C,35,166.77,s,
O,36,,,
O,37,,,
C,38,68.1,s,
C,39,27.2,s,
C,40,33.48,s,
H,41,5.08,dd,"12.0,2.5"
H,42,5.08,dd,"16.0,2.5"
H,43,5.47,ddd,"16.0,12.0,7.0"
H,44,2.14,ddd,"9.8,7.0,6.0"
H,45,5.05,d,9.8
H,46,7.2,d,0.5
H,47,7.09,d,0.5
H,48,3.84,s,
H,49,3.84,s,
H,50,3.84,s,
H,51,3.18,s,
H,52,3.18,s,
H,53,3.18,s,
H,54,4.28,d,2.0
H,55,2.3,ddd,"3.4,2.4,2.0"
H,56,2.05,ddd,"12.4,4.3,2.4"
H,57,2.05,ddd,"12.4,3.4,2.1"
H,58,3.69,ddd,"5.9,4.3,2.1"
H,59,5.49,q,7.0
H,60,1.65,d,7.0
H,61,1.65,d,7.0
H,62,1.65,d,7.0
H,63,3.31,s,
H,64,3.31,s,
H,65,2.64,ddd,"12.4,9.2,6.8"
H,66,2.64,ddd,"12.4,10.7,1.8"
H,67,2.18,ddd,"12.4,10.7,6.8"
H,68,2.18,ddd,"12.4,9.2,1.8"
H,69,3.08,d,5.9
H,70,3.7,s,
H,71,3.7,s,
H,72,3.7,s,
H,73,,,
H,74,8.04,s,
H,75,4.46,ddd,"9.4,4.2,4.0"
H,76,4.46,ddd,"13.0,9.4,2.5"
H,77,1.76,m,
H,78,1.76,m,
H,79,3.09,ddd,"12.0,8.3,6.0"
