C,1,8.74,s,
C,2,28.84,s,
C,3,172.36,s,
O,4,,,
N,5,,,
C,6,31.45,s,
C,7,59.25,s,
C,8,13.9,s,
C,9,170.2,s,
O,10,,,
O,11,,,
C,12,83.52,s,
C,13,41.31,s,
C,14,172.36,s,
O,15,,,
N,16,,,
C,17,32.02,s,
C,18,145.29,s,
C,19,117.11,s,
C,20,134.69,s,
C,21,111.52,s,
C,22,153.03,s,
O,23,,,
C,24,56.57,s,
C,25,129.9,s,
Cl,26,,,
C,27,37.43,s,
C,28,140.22,s,
C,29,19.64,s,
C,30,124.49,s,
C,31,132.45,s,
C,32,133.32,s,
C,33,73.63,s,
O,34,,,
C,35,57.81,s,
C,36,92.26,s,
O,37,,,
C,38,38.58,s,
C,39,77.06,s,
O,40,,,
C,41,156.32,s,
O,42,,,
N,43,,,
C,44,38.31,s,
C,45,12.71,s,
C,46,63.63,s,
O,47,,,
C,48,62.3,s,
C,49,11.4,s,
H,50,1.14,t,7.2
H,51,1.14,t,7.2
H,52,1.14,t,7.2
H,53,2.33,q,7.2
H,54,2.33,q,7.2
H,55,2.91,s,
H,56,2.91,s,
H,57,2.91,s,
H,58,3.15,q,6.8
H,59,1.23,d,6.8
H,60,1.23,d,6.8
H,61,1.23,d,6.8
H,62,4.54,dd,"10.2,1.3"
H,63,2.73,dd,"15.4,10.2"
H,64,2.73,dd,"15.4,1.3"
H,65,3.72,s,
H,66,3.72,s,
H,67,3.72,s,
H,68,7.51,d,1.9
H,69,6.94,d,1.9
H,70,3.87,s,
H,71,3.87,s,
H,72,3.87,s,
H,73,3.38,s,
H,74,3.38,s,
H,75,1.75,s,
H,76,1.75,s,
H,77,1.75,s,
H,78,6.34,d,2.9
H,79,6.87,d,2.9
H,80,6.14,d,6.9
H,81,4.52,d,6.9
H,82,3.42,s,
H,83,3.42,s,
H,84,3.42,s,
H,85,,,
H,86,3.55,dd,"12.4,1.5"
H,87,3.55,dd,"12.4,11.7"
H,88,4.88,ddd,"11.7,10.0,1.5"
H,89,,,
H,90,1.8,ddq,"10.2,10.0,6.6"
H,91,0.88,d,6.6
H,92,0.88,d,6.6
H,93,0.88,d,6.6
H,94,2.88,d,10.2
H,95,1.4,s,
H,96,1.4,s,
H,97,1.4,s,
