C,1,15.35,s,
C,2,60.43,s,
O,3,,,
C,4,82.84,s,
C,5,40.59,s,
C,6,83.52,s,
O,7,,,
C,8,49.1,s,
C,9,74.2,s,
O,10,,,
C,11,36.2,s,
C,12,41.4,s,
C,13,48.16,s,
C,14,79.1,s,
O,15,,,
C,16,166.26,s,
O,17,,,
C,18,123.71,s,
C,19,131.99,s,
C,20,113.7,s,
C,21,163.46,s,
O,22,,,
C,23,55.32,s,
C,24,113.7,s,
C,25,131.99,s,
C,26,49.44,s,
C,27,81.22,s,
O,28,,,
C,29,56.6,s,
C,30,133.32,s,
C,31,144.6,s,
C,32,41.86,s,
C,33,72.44,s,
O,34,,,
C,35,58.89,s,
C,36,62.58,s,
N,37,,,
C,38,48.08,s,
C,39,13.14,s,
C,40,60.94,s,
C,41,46.79,s,
C,42,81.34,s,
O,43,,,
C,44,57.68,s,
C,45,51.51,s,
H,46,1.24,t,6.7
H,47,1.24,t,6.7
H,48,1.24,t,6.7
H,49,3.66,q,6.7
H,50,3.66,q,6.7
H,51,3.0,dd,"12.4,7.5"
H,52,3.0,dd,"12.4,8.1"
H,53,4.54,dd,"8.1,7.5"
H,54,3.28,s,
H,55,3.28,s,
H,56,3.28,s,
H,57,,,
H,58,1.96,dd,"12.4,3.4"
H,59,1.96,dd,"12.4,10.5"
H,60,2.08,ddd,"10.5,5.5,3.4"
H,61,2.84,dd,"5.5,1.6"
H,62,4.96,d,1.6
H,63,7.94,ddd,"6.5,1.9,0.5"
H,64,6.88,ddd,"6.5,1.9,0.5"
H,65,3.76,s,
H,66,3.76,s,
H,67,3.76,s,
H,68,6.88,ddd,"8.6,1.9,0.5"
H,69,7.94,ddd,"8.6,1.9,0.5"
H,70,4.9,d,6.3
H,71,3.42,s,
H,72,3.42,s,
H,73,3.42,s,
H,74,6.14,d,6.3
H,75,6.3,s,
H,76,4.13,s,
H,77,4.13,s,
H,78,3.28,s,
H,79,3.28,s,
H,80,3.28,s,
H,81,3.17,s,
H,82,3.17,s,
H,83,2.5,q,6.8
H,84,2.5,q,6.8
H,85,1.07,t,6.8
H,86,1.07,t,6.8
H,87,1.07,t,6.8
H,88,2.83,d,0.8
H,89,2.42,dd,"8.0,0.8"
H,90,4.22,dd,"8.0,4.0"
H,91,3.27,s,
H,92,3.27,s,
H,93,3.27,s,
H,94,2.9,d,4.0
