C,1,20.45,s,
C,2,169.75,s,
O,3,,,
O,4,,,
C,5,60.45,s,
C,6,52.75,s,
C,7,71.4,s,
O,8,,,
C,9,169.05,s,
C,10,21.15,s,
O,11,,,
C,12,70.57,s,
O,13,,,
C,14,165.1,s,
C,15,20.5,s,
O,16,,,
C,17,40.4,s,
C,18,76.6,s,
O,19,,,
C,20,93.16,s,
O,21,,,
C,22,85.37,s,
C,23,19.2,s,
C,24,70.07,s,
O,25,,,
C,26,165.53,s,
O,27,,,
C,28,121.33,s,
C,29,137.2,s,
C,30,124.1,s,
C,31,147.2,s,
N,32,,,
C,33,161.49,s,
C,34,31.7,s,
C,35,28.16,s,
C,36,39.06,s,
C,37,16.98,s,
C,38,175.75,s,
O,39,,,
O,40,,,
C,41,75.2,s,
C,42,80.31,s,
O,43,,,
C,44,165.68,s,
O,45,,,
C,46,130.33,s,
C,47,129.65,s,
C,48,128.88,s,
C,49,133.32,s,
C,50,128.88,s,
C,51,129.65,s,
C,52,71.6,s,
O,53,,,
C,54,165.37,s,
O,55,,,
C,56,131.63,s,
C,57,129.51,s,
C,58,128.88,s,
C,59,133.32,s,
C,60,128.88,s,
C,61,129.51,s,
C,62,70.2,s,
C,63,23.17,s,
O,64,,,
H,65,2.07,s,
H,66,2.07,s,
H,67,2.07,s,
H,68,5.24,s,
H,69,5.24,s,
H,70,5.32,d,5.0
H,71,2.0,s,
H,72,2.0,s,
H,73,2.0,s,
H,74,5.54,dd,"5.0,0.3"
H,75,2.03,s,
H,76,2.03,s,
H,77,2.03,s,
H,78,2.83,dd,"3.9,0.3"
H,79,3.82,d,3.9
H,80,,,
H,81,1.69,s,
H,82,1.69,s,
H,83,1.69,s,
H,84,5.95,s,
H,85,5.95,s,
H,86,8.3,dd,"9.1,1.4"
H,87,7.51,dd,"9.1,4.6"
H,88,8.56,dd,"4.6,1.4"
H,89,2.72,ddd,"15.4,11.8,5.5"
H,90,2.72,ddd,"15.4,5.0,3.9"
H,91,1.58,m,
H,92,1.58,m,
H,93,2.41,dqd,"8.6,6.7,1.0"
H,94,1.13,d,6.7
H,95,1.13,d,6.7
H,96,1.13,d,6.7
H,97,4.75,d,2.5
H,98,5.21,dd,"2.5,2.3"
H,99,8.03,m,
H,100,7.46,m,
H,101,7.57,ddt,"8.2,6.8,1.4"
H,102,7.46,m,
H,103,8.03,m,
H,104,5.71,d,2.3
H,105,8.03,m,
H,106,7.46,m,
H,107,7.57,ddt,"7.9,7.5,1.4"
H,108,7.46,m,
H,109,8.03,m,
H,110,1.54,s,
H,111,1.54,s,
H,112,1.54,s,
H,113,,,
