C,1,7.59,s,
C,2,28.07,s,
C,3,73.68,s,
O,4,,,
C,5,40.59,s,
C,6,75.98,s,
O,7,,,
C,8,100.5,s,
C,9,33.7,s,
C,10,63.83,s,
N,11,,,
C,12,41.56,s,
C,13,41.56,s,
C,14,78.37,s,
O,15,,,
C,16,101.47,s,
C,17,38.88,s,
C,18,69.64,s,
O,19,,,
C,20,85.22,s,
O,21,,,
C,22,98.35,s,
O,23,,,
C,24,77.12,s,
C,25,16.27,s,
C,26,197.79,s,
O,27,,,
C,28,103.3,s,
C,29,145.66,s,
N,30,,,
C,31,69.88,s,
C,32,18.31,s,
O,33,,,
C,34,72.56,s,
C,35,17.64,s,
O,36,,,
C,37,126.72,s,
C,38,155.0,s,
O,39,,,
C,40,110.3,s,
C,41,110.28,s,
C,42,159.52,s,
O,43,,,
C,44,126.51,s,
C,45,40.4,s,
C,46,172.96,s,
O,47,,,
O,48,,,
C,49,52.08,s,
C,50,186.0,s,
O,51,,,
C,52,132.7,s,
C,53,118.9,s,
C,54,137.1,s,
C,55,124.23,s,
C,56,161.6,s,
O,57,,,
C,58,116.17,s,
C,59,186.0,s,
O,60,,,
H,61,0.86,t,7.1
H,62,0.86,t,7.1
H,63,0.86,t,7.1
H,64,1.49,q,7.1
H,65,1.49,q,7.1
H,66,,,
H,67,2.27,dd,"12.4,4.2"
H,68,2.27,dd,"12.7,12.4"
H,69,5.64,dd,"12.7,4.2"
H,70,5.47,dd,"8.8,3.9"
H,71,2.16,ddd,"12.4,3.9,1.5"
H,72,2.16,ddd,"12.4,8.8,8.7"
H,73,3.41,ddd,"8.7,1.7,1.5"
H,74,2.84,s,
H,75,2.84,s,
H,76,2.84,s,
H,77,2.84,s,
H,78,2.84,s,
H,79,2.84,s,
H,80,4.91,dd,"9.0,1.7"
H,81,4.72,dd,"8.7,6.0"
H,82,1.88,ddd,"12.4,9.3,8.7"
H,83,1.88,ddd,"12.4,6.0,5.2"
H,84,3.63,ddd,"9.3,9.2,5.2"
H,85,,,
H,86,3.04,dd,"9.6,9.2"
H,87,5.85,s,
H,88,4.13,q,6.2
H,89,1.26,d,6.2
H,90,1.26,d,6.2
H,91,1.26,d,6.2
H,92,6.44,s,
H,93,,,
H,94,,,
H,95,3.39,dq,"9.6,6.1"
H,96,1.32,d,6.1
H,97,1.32,d,6.1
H,98,1.32,d,6.1
H,99,3.91,dq,"9.0,6.1"
H,100,1.3,d,6.1
H,101,1.3,d,6.1
H,102,1.3,d,6.1
H,103,,,
H,104,,,
H,105,5.83,s,
H,106,3.62,s,
H,107,3.62,s,
H,108,3.62,s,
H,109,7.76,dd,"7.3,1.4"
H,110,7.69,dd,"7.3,6.8"
H,111,7.32,dd,"6.8,1.4"
H,112,,,
