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,18,70.2,s,
O,19,,,
C,20,86.14,s,
O,21,,,
C,22,100.5,s,
C,23,26.3,s,
C,24,38.33,s,
C,25,,,
O,26,,,
C,27,77.12,s,
C,28,16.27,s,
O,29,,,
C,30,70.11,s,
C,31,18.2,s,
O,32,,,
C,33,72.56,s,
C,34,17.64,s,
O,35,,,
C,36,126.72,s,
C,37,155.0,s,
O,38,,,
C,39,110.3,s,
C,40,110.28,s,
C,41,159.52,s,
O,42,,,
C,43,126.51,s,
C,44,40.4,s,
C,45,172.96,s,
O,46,,,
O,47,,,
C,48,52.08,s,
C,49,186.0,s,
O,50,,,
C,51,132.7,s,
C,52,118.9,s,
C,53,137.1,s,
C,54,124.23,s,
C,55,161.6,s,
O,56,,,
C,57,116.17,s,
C,58,186.0,s,
O,59,,,
H,60,0.86,t,7.1
H,61,0.86,t,7.1
H,62,0.86,t,7.1
H,63,1.49,q,7.1
H,64,1.49,q,7.1
H,65,,,
H,66,2.27,dd,"12.4,4.5"
H,67,2.27,dd,"13.6,12.4"
H,68,5.64,dd,"13.6,4.5"
H,69,5.47,dd,"7.5,0.4"
H,70,2.16,ddd,"12.4,7.5,2.8"
H,71,2.16,ddd,"12.4,3.0,0.4"
H,72,3.41,ddd,"8.1,3.0,2.8"
H,73,2.84,s,
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,79,4.91,dd,"8.1,7.8"
H,80,4.72,dd,"12.9,5.6"
H,81,1.88,ddd,"12.4,5.7,5.6"
H,82,1.88,ddd,"12.9,12.4,0.8"
H,83,3.63,ddd,"5.7,3.8,0.8"
H,84,,,
H,85,3.04,dd,"7.7,3.8"
H,86,4.95,dd,"9.5,2.4"
H,87,2.05,m,
H,88,2.05,m,
H,89,2.67,ddd,"15.4,9.4,1.4"
H,90,2.67,ddd,"15.4,11.6,9.2"
H,91,4.13,q,6.2
H,92,1.26,d,6.2
H,93,1.26,d,6.2
H,94,1.26,d,6.2
H,95,3.39,dq,"7.7,6.1"
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,"7.8,6.1"
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,"6.3,1.4"
H,110,7.69,dd,"8.8,6.3"
H,111,7.32,dd,"8.8,1.4"
H,112,,,
