C,1,122.6,s,
C,2,136.6,s,
C,3,168.6,s,
O,4,,,
O,5,,,
C,6,75.3,s,
C,7,53.1,s,
C,8,72.8,s,
O,9,,,
C,10,166.8,s,
O,11,,,
C,12,126.0,s,
C,13,20.35,s,
C,14,139.28,s,
C,15,15.61,s,
C,16,35.2,s,
C,17,150.99,s,
C,18,109.66,s,
C,19,77.48,s,
O,20,,,
C,21,135.73,s,
C,22,135.73,s,
C,23,70.0,s,
C,24,23.7,s,
O,25,,,
C,26,59.47,s,
H,27,5.94,s,
H,28,5.94,s,
H,29,4.8,dd,"7.9,6.4"
H,30,2.73,dd,"9.0,7.9"
H,31,4.54,ddd,"12.7,9.0,2.1"
H,32,1.87,s,
H,33,1.87,s,
H,34,1.87,s,
H,35,6.46,q,7.0
H,36,1.9,d,7.0
H,37,1.9,d,7.0
H,38,1.9,d,7.0
H,39,2.52,dd,"13.4,12.7"
H,40,2.52,dd,"13.4,2.1"
H,41,5.18,s,
H,42,5.18,s,
H,43,,,
H,44,5.99,s,
H,45,5.99,s,
H,46,1.53,s,
H,47,1.53,s,
H,48,1.53,s,
H,49,,,
H,50,2.83,d,6.4
