C,1,126.65,s,
C,2,135.7,s,
C,3,19.75,s,
C,4,166.4,s,
O,5,,,
O,6,,,
C,7,71.13,s,
C,8,44.57,s,
C,9,140.22,s,
C,10,19.64,s,
C,11,142.75,s,
C,12,105.1,s,
O,13,,,
C,14,49.86,s,
C,15,142.75,s,
C,16,137.53,s,
C,17,14.8,s,
C,18,77.48,s,
O,19,,,
C,20,79.25,s,
O,21,,,
C,22,169.53,s,
O,23,,,
C,24,135.34,s,
C,25,121.49,s,
C,26,53.78,s,
H,27,5.87,s,
H,28,5.87,s,
H,29,1.94,s,
H,30,1.94,s,
H,31,1.94,s,
H,32,4.58,ddd,"10.6,3.0,1.4"
H,33,2.55,dd,"15.4,1.4"
H,34,2.55,dd,"15.4,10.6"
H,35,1.75,s,
H,36,1.75,s,
H,37,1.75,s,
H,38,6.44,s,
H,39,3.4,s,
H,40,3.4,s,
H,41,3.4,s,
H,42,6.44,s,
H,43,1.76,s,
H,44,1.76,s,
H,45,1.76,s,
H,46,5.09,d,7.8
H,47,4.66,dd,"11.4,7.8"
H,48,5.94,s,
H,49,5.94,s,
H,50,2.73,dd,"11.4,3.0"
