C,1,20.5,s,
C,2,169.8,s,
O,3,,,
O,4,,,
C,5,60.4,s,
C,6,52.2,s,
C,7,77.4,s,
O,8,,,
C,9,169.4,s,
C,10,20.2,s,
O,11,,,
C,12,196.4,s,
O,13,,,
C,14,61.9,s,
C,15,73.9,s,
O,16,,,
C,17,169.5,s,
C,18,21.3,s,
O,19,,,
C,20,94.5,s,
O,21,,,
C,22,85.8,s,
C,23,19.2,s,
C,24,70.1,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,35,35.22,s,
C,36,75.41,s,
C,37,25.33,s,
O,38,,,
C,39,172.75,s,
O,40,,,
O,41,,,
C,42,75.2,s,
C,43,80.31,s,
O,44,,,
C,45,165.68,s,
O,46,,,
C,47,130.33,s,
C,48,129.65,s,
C,49,128.88,s,
C,50,133.32,s,
C,51,128.88,s,
C,52,129.65,s,
C,53,71.6,s,
O,54,,,
C,55,165.37,s,
O,56,,,
C,57,131.63,s,
C,58,129.51,s,
C,59,128.88,s,
C,60,133.32,s,
C,61,128.88,s,
C,62,129.51,s,
C,63,69.5,s,
C,64,23.8,s,
O,65,,,
H,66,2.07,s,
H,67,2.07,s,
H,68,2.07,s,
H,69,5.19,s,
H,70,5.19,s,
H,71,6.08,s,
H,72,2.0,s,
H,73,2.0,s,
H,74,2.0,s,
H,75,3.01,d,3.9
H,76,6.73,d,3.9
H,77,2.04,s,
H,78,2.04,s,
H,79,2.04,s,
H,80,1.69,s,
H,81,1.69,s,
H,82,1.69,s,
H,83,5.95,s,
H,84,5.95,s,
H,85,8.3,dd,"8.0,1.4"
H,86,7.51,dd,"8.0,4.4"
H,87,8.56,dd,"4.4,1.4"
H,88,2.72,ddd,"15.4,11.5,0.6"
H,89,2.72,ddd,"15.4,11.4,1.5"
H,90,1.9,ddd,"12.4,11.5,1.5"
H,91,1.9,ddd,"12.4,11.4,0.6"
H,92,1.47,s,
H,93,1.47,s,
H,94,1.47,s,
H,95,,,
H,96,4.75,d,3.9
H,97,5.21,dd,"7.5,3.9"
H,98,8.03,m,
H,99,7.46,m,
H,100,7.57,ddt,"7.5,7.0,1.4"
H,101,7.46,m,
H,102,8.03,m,
H,103,5.71,d,7.5
H,104,8.03,m,
H,105,7.46,m,
H,106,7.57,ddt,"8.3,7.5,1.4"
H,107,7.46,m,
H,108,8.03,m,
H,109,1.54,s,
H,110,1.54,s,
H,111,1.54,s,
H,112,,,
