C,1,13.51,s,
C,2,125.03,s,
C,3,132.62,s,
C,4,72.9,s,
N,5,,,
O,6,,,
C,7,66.54,s,
C,8,36.49,s,
C,9,41.86,s,
C,10,142.69,s,
C,11,145.17,s,
C,12,63.31,s,
O,13,,,
C,14,40.4,s,
C,15,30.5,s,
C,16,102.3,s,
N,17,,,
C,18,142.9,s,
C,19,115.48,s,
C,20,130.88,s,
C,21,122.44,s,
C,22,124.58,s,
C,23,134.28,s,
H,24,1.83,d,7.0
H,25,1.83,d,7.0
H,26,1.83,d,7.0
H,27,6.26,q,7.0
H,28,4.28,s,
H,29,4.28,s,
H,30,3.65,ddd,"10.9,9.4,7.4"
H,31,3.65,ddd,"10.9,9.4,2.7"
H,32,2.37,ddd,"12.4,10.9,7.4"
H,33,2.37,ddd,"12.4,10.9,2.7"
H,34,5.99,s,
H,35,4.66,s,
H,36,4.66,s,
H,37,,,
H,38,2.83,dd,"4.4,2.6"
H,39,2.05,dd,"12.4,2.6"
H,40,2.05,dd,"12.4,4.4"
H,41,,,
H,42,7.15,ddd,"7.7,1.4,0.5"
H,43,7.22,ddd,"7.7,7.2,1.4"
H,44,6.94,ddd,"7.9,7.2,1.4"
H,45,7.25,ddd,"7.9,1.4,0.5"
