C,1,10.35,s,
C,2,49.72,s,
C,3,,,
O,4,,,
C,5,41.86,s,
C,6,48.86,s,
C,7,41.86,s,
C,8,144.6,s,
C,9,124.8,s,
C,10,57.5,s,
N,11,,,
C,12,51.33,s,
C,13,38.94,s,
C,14,41.86,s,
C,15,134.28,s,
C,16,124.58,s,
C,17,122.44,s,
C,18,132.76,s,
C,19,124.0,s,
C,20,145.91,s,
N,21,,,
C,22,162.36,s,
O,23,,,
C,24,74.2,s,
H,25,1.18,d,6.8
H,26,1.18,d,6.8
H,27,1.18,d,6.8
H,28,2.9,q,6.8
H,29,2.06,s,
H,30,2.06,s,
H,31,6.3,d,11.0
H,32,5.59,ddd,"11.0,5.3,2.7"
H,33,4.04,dd,"15.4,2.7"
H,34,4.04,dd,"15.4,5.3"
H,35,3.11,ddd,"11.3,9.4,2.4"
H,36,3.11,ddd,"9.9,9.4,5.9"
H,37,2.18,ddd,"12.4,9.9,2.4"
H,38,2.18,ddd,"12.4,11.3,5.9"
H,39,7.25,ddd,"8.3,1.4,0.5"
H,40,6.94,ddd,"8.3,7.5,1.4"
H,41,7.51,ddd,"7.5,7.0,1.4"
H,42,7.48,ddd,"7.0,1.4,0.5"
H,43,,,
H,44,4.28,s,
