C,1,16.48,s,
C,2,162.36,s,
O,3,,,
N,4,,,
C,5,138.07,s,
C,6,,,
S,7,,,
O,8,,,
C,9,88.0,s,
C,10,145.66,s,
C,11,166.24,s,
O,12,,,
O,13,,,
N,14,,,
C,15,169.15,s,
O,16,,,
C,17,40.4,s,
C,18,77.48,s,
C,19,25.81,s,
C,20,25.81,s,
O,21,,,
S,22,,,
O,23,,,
O,24,,,
O,25,,,
C,26,57.53,s,
C,27,30.5,s,
H,28,2.13,s,
H,29,2.13,s,
H,30,2.13,s,
H,31,,,
H,32,7.47,d,14.0
H,33,6.97,d,14.0
H,34,,,
H,35,2.83,d,9.8
H,36,1.4,s,
H,37,1.4,s,
H,38,1.4,s,
H,39,1.4,s,
H,40,1.4,s,
H,41,1.4,s,
H,42,,,
H,43,4.09,ddd,"11.9,9.8,5.9"
H,44,2.05,dd,"12.4,11.9"
H,45,2.05,dd,"12.4,5.9"
