C,1,52.29,s,
O,2,,,
C,3,174.33,s,
O,4,,,
C,5,41.86,s,
C,6,113.19,s,
C,7,157.83,s,
O,8,,,
C,9,57.75,s,
C,10,69.05,s,
Cl,11,,,
C,12,77.48,s,
O,13,,,
C,14,,,
O,15,,,
C,16,153.15,s,
C,17,132.07,s,
C,18,130.07,s,
C,19,70.66,s,
O,20,,,
C,21,62.7,s,
O,22,,,
C,23,77.48,s,
C,24,37.62,s,
C,25,115.61,s,
C,26,137.39,s,
C,27,21.77,s,
C,28,21.77,s,
C,29,78.03,s,
O,30,,,
C,31,165.89,s,
O,32,,,
C,33,98.7,s,
C,34,160.5,s,
O,35,,,
C,36,108.9,s,
C,37,148.4,s,
C,38,22.0,s,
C,39,108.9,s,
C,40,160.5,s,
O,41,,,
C,42,142.69,s,
C,43,41.86,s,
C,44,23.79,s,
C,45,48.86,s,
H,46,3.63,s,
H,47,3.63,s,
H,48,3.63,s,
H,49,6.25,s,
H,50,3.74,s,
H,51,3.74,s,
H,52,3.74,s,
H,53,,,
H,54,5.77,d,2.6
H,55,4.22,dd,"9.4,2.6"
H,56,,,
H,57,3.36,d,9.4
H,58,2.3,d,7.0
H,59,2.3,d,7.0
H,60,5.54,t,7.0
H,61,1.65,s,
H,62,1.65,s,
H,63,1.65,s,
H,64,1.65,s,
H,65,1.65,s,
H,66,1.65,s,
H,67,5.31,s,
H,68,,,
H,69,6.77,s,
H,70,2.09,s,
H,71,2.09,s,
H,72,2.09,s,
H,73,6.77,s,
H,74,,,
H,75,5.99,s,
H,76,1.13,s,
H,77,1.13,s,
H,78,1.13,s,
H,79,2.06,s,
H,80,2.06,s,
