C,1,60.0,s,
O,2,,,
C,3,158.05,s,
C,4,102.55,s,
C,5,105.55,s,
C,6,143.63,s,
O,7,,,
C,8,165.8,s,
N,9,,,
C,10,142.9,s,
C,11,142.1,s,
O,12,,,
C,13,61.9,s,
C,14,153.9,s,
O,15,,,
C,16,72.5,s,
C,17,77.8,s,
O,18,,,
C,19,72.8,s,
C,20,25.95,s,
C,21,25.95,s,
O,22,,,
C,23,114.0,s,
C,24,119.5,s,
C,25,115.9,s,
H,26,4.22,s,
H,27,4.22,s,
H,28,4.22,s,
H,29,7.08,d,2.5
H,30,7.5,d,2.5
H,31,3.83,s,
H,32,3.83,s,
H,33,3.83,s,
H,34,4.05,d,5.5
H,35,4.05,d,5.5
H,36,4.15,t,5.5
H,37,,,
H,38,1.3,s,
H,39,1.3,s,
H,40,1.3,s,
H,41,1.3,s,
H,42,1.3,s,
H,43,1.3,s,
H,44,,,
H,45,7.94,d,6.4
H,46,8.09,d,6.4
