C,1,20.25,s,
C,2,29.5,s,
C,3,20.25,s,
C,4,45.18,s,
C,5,48.5,s,
C,6,172.96,s,
O,7,,,
O,8,,,
C,9,82.0,s,
C,10,57.53,s,
N,11,,,
C,12,31.45,s,
C,13,173.33,s,
O,14,,,
C,15,52.6,s,
C,16,28.16,s,
C,17,26.26,s,
C,18,50.54,s,
C,19,41.86,s,
C,20,23.79,s,
H,21,0.88,d,6.4
H,22,0.88,d,6.4
H,23,0.88,d,6.4
H,24,1.87,m,"6.4,5.5"
H,25,0.88,d,6.4
H,26,0.88,d,6.4
H,27,0.88,d,6.4
H,28,2.77,dd,"9.7,5.5"
H,29,2.83,dd,"17.9,9.7"
H,30,5.47,d,10.1
H,31,4.28,d,10.1
H,32,2.91,s,
H,33,2.91,s,
H,34,2.91,s,
H,35,4.18,dd,"12.1,3.5"
H,36,1.58,m,
H,37,1.58,m,
H,38,1.48,m,
H,39,1.48,m,
H,40,1.61,ddd,"17.9,17.3,9.3"
H,41,1.13,s,
H,42,1.13,s,
H,43,1.13,s,
