C,1,52.29,s,
O,2,,,
C,3,174.33,s,
O,4,,,
C,5,41.86,s,
C,6,42.83,s,
C,7,73.63,s,
O,8,,,
C,9,57.81,s,
C,10,69.05,s,
Cl,11,,,
C,12,41.86,s,
C,13,23.79,s,
C,14,142.69,s,
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,28,73.63,s,
O,29,,,
O,30,,,
C,31,77.48,s,
C,32,105.64,s,
O,33,,,
C,34,165.89,s,
O,35,,,
C,36,103.04,s,
C,37,162.17,s,
O,38,,,
C,39,107.4,s,
C,40,146.43,s,
C,41,21.73,s,
C,42,111.91,s,
C,43,156.64,s,
O,44,,,
C,45,30.5,s,
H,46,3.63,s,
H,47,3.63,s,
H,48,3.63,s,
H,49,2.1,dd,"12.4,4.7"
H,50,2.1,dd,"12.4,9.6"
H,51,5.66,dd,"9.6,4.7"
H,52,3.42,s,
H,53,3.42,s,
H,54,3.42,s,
H,55,1.13,s,
H,56,1.13,s,
H,57,1.13,s,
H,58,5.99,s,
H,59,5.77,d,5.6
H,60,4.22,dd,"8.0,5.6"
H,61,,,
H,62,3.36,d,8.0
H,63,2.3,d,7.0
H,64,2.3,d,7.0
H,65,5.54,t,7.0
H,66,1.65,s,
H,67,1.65,s,
H,68,1.65,s,
H,69,1.65,s,
H,70,1.65,s,
H,71,1.65,s,
H,72,4.52,s,
H,73,,,
H,74,6.77,d,1.9
H,75,2.28,s,
H,76,2.28,s,
H,77,2.28,s,
H,78,6.7,d,1.9
H,79,2.05,s,
H,80,2.05,s,
