C,1,52.29,s,
O,2,,,
C,3,174.33,s,
O,4,,,
C,5,63.5,s,
C,6,49.84,s,
C,7,,,
O,8,,,
C,9,69.05,s,
Cl,10,,,
C,11,77.48,s,
O,12,,,
C,13,,,
O,14,,,
C,15,153.15,s,
C,16,132.07,s,
C,17,130.07,s,
C,18,70.66,s,
O,19,,,
C,20,62.7,s,
O,21,,,
C,22,77.48,s,
C,23,37.62,s,
C,24,115.61,s,
C,25,137.39,s,
C,26,21.77,s,
C,27,21.77,s,
C,28,78.03,s,
O,29,,,
C,30,165.89,s,
O,31,,,
C,32,98.7,s,
C,33,160.5,s,
O,34,,,
C,35,108.9,s,
C,36,148.4,s,
C,37,22.0,s,
C,38,108.9,s,
C,39,160.5,s,
O,40,,,
C,41,142.69,s,
C,42,41.86,s,
C,43,23.79,s,
C,44,48.86,s,
H,45,3.63,s,
H,46,3.63,s,
H,47,3.63,s,
H,48,2.57,s,
H,49,2.57,s,
H,50,,,
H,51,5.77,d,2.8
H,52,4.22,dd,"2.8,1.4"
H,53,,,
H,54,3.36,d,1.4
H,55,2.3,d,7.0
H,56,2.3,d,7.0
H,57,5.54,t,7.0
H,58,1.65,s,
H,59,1.65,s,
H,60,1.65,s,
H,61,1.65,s,
H,62,1.65,s,
H,63,1.65,s,
H,64,5.31,s,
H,65,,,
H,66,6.77,s,
H,67,2.09,s,
H,68,2.09,s,
H,69,2.09,s,
H,70,6.77,s,
H,71,,,
H,72,5.99,s,
H,73,1.13,s,
H,74,1.13,s,
H,75,1.13,s,
H,76,2.06,s,
H,77,2.06,s,
