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,7,66.8,s,
C,8,36.49,s,
C,9,41.86,s,
C,10,157.99,s,
N,11,,,
C,12,156.48,s,
C,13,120.77,s,
C,14,128.7,s,
C,15,126.23,s,
C,16,124.56,s,
C,17,138.55,s,
C,18,71.6,s,
C,19,30.5,s,
C,20,47.74,s,
C,21,41.86,s,
C,22,67.18,s,
O,23,,,
C,24,174.33,s,
O,25,,,
O,26,,,
C,27,52.29,s,
H,28,1.83,d,7.0
H,29,1.83,d,7.0
H,30,1.83,d,7.0
H,31,6.26,q,7.0
H,32,4.28,s,
H,33,4.28,s,
H,34,3.65,ddd,"12.5,12.4,5.0"
H,35,3.65,ddd,"12.4,5.8,1.6"
H,36,2.37,ddd,"12.5,12.4,5.8"
H,37,2.37,ddd,"12.4,5.0,1.6"
H,38,7.52,ddd,"6.8,1.4,0.5"
H,39,7.33,ddd,"7.7,6.8,1.4"
H,40,7.28,ddd,"9.2,7.7,1.4"
H,41,7.62,ddd,"9.2,1.4,0.5"
H,42,4.86,dd,"2.9,2.4"
H,43,0.91,ddd,"12.4,2.9,2.6"
H,44,0.91,ddd,"12.4,4.6,2.4"
H,45,2.94,dd,"4.6,2.6"
H,46,3.97,s,
H,47,3.97,s,
H,48,,,
H,49,3.63,s,
H,50,3.63,s,
H,51,3.63,s,
