C,1,16.95,s,
C,2,32.6,s,
C,3,16.95,s,
C,4,76.1,s,
O,5,,,
C,6,65.9,s,
O,7,,,
C,8,35.22,s,
C,9,35.22,s,
C,10,74.2,s,
C,11,26.7,s,
O,12,,,
C,13,52.87,s,
C,14,24.59,s,
C,15,34.35,s,
C,16,48.86,s,
C,17,19.23,s,
C,18,47.69,s,
C,19,26.79,s,
C,20,21.36,s,
C,21,48.76,s,
C,22,48.79,s,
C,23,21.15,s,
C,24,174.33,s,
O,25,,,
O,26,,,
C,27,95.48,s,
O,28,,,
C,29,78.59,s,
C,30,62.47,s,
O,31,,,
C,32,71.06,s,
O,33,,,
C,34,78.34,s,
O,35,,,
C,36,70.15,s,
O,37,,,
C,38,75.84,s,
O,39,,,
C,40,36.69,s,
C,41,75.84,s,
O,42,,,
C,43,41.86,s,
C,44,19.73,s,
C,45,23.43,s,
C,46,26.43,s,
C,47,32.64,s,
C,48,43.99,s,
C,49,17.82,s,
H,50,0.94,d,6.6
H,51,0.94,d,6.6
H,52,0.94,d,6.6
H,53,1.87,m,6.6
H,54,0.94,d,6.6
H,55,0.94,d,6.6
H,56,0.94,d,6.6
H,57,,,
H,58,3.54,s,
H,59,3.54,s,
H,60,,,
H,61,1.9,t,6.8
H,62,1.9,t,6.8
H,63,1.9,t,6.8
H,64,1.9,t,6.8
H,65,1.31,s,
H,66,1.31,s,
H,67,1.31,s,
H,68,,,
H,69,2.29,dd,"13.5,6.6"
H,70,1.96,m,
H,71,1.96,m,
H,72,1.39,ddd,"12.7,12.4,7.2"
H,73,1.39,ddd,"12.4,5.5,0.5"
H,74,0.93,s,
H,75,0.93,s,
H,76,0.93,s,
H,77,1.63,dd,"10.8,2.4"
H,78,1.92,m,
H,79,1.92,m,
H,80,1.69,m,
H,81,1.69,m,
H,82,3.24,dd,"7.7,1.6"
H,83,1.61,s,
H,84,1.61,s,
H,85,1.61,s,
H,86,6.11,d,2.7
H,87,3.93,dt,"7.9,5.4"
H,88,4.04,d,5.4
H,89,4.04,d,5.4
H,90,,,
H,91,3.82,dd,"7.9,4.8"
H,92,,,
H,93,3.96,dd,"6.5,4.8"
H,94,,,
H,95,4.16,dd,"6.5,2.7"
H,96,,,
H,97,5.37,dd,"7.9,1.7"
H,98,,,
H,99,2.41,ddd,"12.4,8.2,1.7"
H,100,2.41,ddd,"12.4,7.9,1.5"
H,101,3.86,dd,"8.2,1.5"
H,102,,,
H,103,0.79,s,
H,104,0.79,s,
H,105,2.67,ddd,"13.6,12.4,0.6"
H,106,2.67,ddd,"12.4,7.4,3.0"
H,107,2.01,ddd,"13.6,12.4,3.0"
H,108,2.01,ddd,"12.4,7.4,0.6"
H,109,1.02,s,
H,110,1.02,s,
H,111,1.02,s,
