C,1,15.33,s,
C,2,59.83,s,
O,3,,,
C,4,108.53,s,
C,5,44.35,s,
C,6,61.5,s,
O,7,,,
C,8,59.4,s,
C,9,21.8,s,
C,10,25.99,s,
C,11,40.4,s,
C,12,15.7,s,
C,13,43.82,s,
C,14,18.07,s,
C,15,34.9,s,
C,16,159.36,s,
C,17,129.4,s,
C,18,8.7,s,
C,19,169.9,s,
O,20,,,
O,21,,,
H,22,1.18,t,6.7
H,23,1.18,t,6.7
H,24,1.18,t,6.7
H,25,3.55,q,6.7
H,26,3.55,q,6.7
H,27,1.75,s,
H,28,1.75,s,
H,29,2.88,dd,"5.0,0.6"
H,30,2.09,m,
H,31,2.09,m,
H,32,1.67,m,
H,33,1.67,m,
H,34,1.82,ddq,"10.1,7.3,6.6"
H,35,0.92,d,6.6
H,36,0.92,d,6.6
H,37,0.92,d,6.6
H,38,1.05,s,
H,39,1.05,s,
H,40,1.05,s,
H,41,2.4,s,
H,42,2.4,s,
H,43,1.82,s,
H,44,1.82,s,
H,45,1.82,s,
