C,1,16.48,s,
C,2,162.36,s,
O,3,,,
N,4,,,
C,5,57.53,s,
C,6,100.22,s,
O,7,,,
C,8,74.38,s,
C,9,71.35,s,
O,10,,,
C,11,71.89,s,
C,12,29.74,s,
C,13,26.12,s,
C,14,29.54,s,
C,15,29.69,s,
C,16,29.66,s,
C,17,29.55,s,
C,18,29.26,s,
C,19,29.26,s,
C,20,29.26,s,
C,21,29.26,s,
C,22,29.55,s,
C,23,29.66,s,
C,24,29.4,s,
C,25,29.42,s,
C,26,25.93,s,
C,27,32.83,s,
C,28,62.68,s,
O,29,,,
C,30,67.4,s,
O,31,,,
C,32,102.46,s,
O,33,,,
C,34,66.28,s,
C,35,70.2,s,
O,36,,,
C,37,77.4,s,
O,38,,,
C,39,73.67,s,
O,40,,,
O,41,,,
C,42,73.4,s,
C,43,60.83,s,
O,44,,,
C,45,70.49,s,
O,46,,,
C,47,73.63,s,
O,48,,,
H,49,2.13,s,
H,50,2.13,s,
H,51,2.13,s,
H,52,,,
H,53,4.17,dd,"10.9,6.8"
H,54,5.07,d,6.8
H,55,4.4,m,5.3
H,56,3.56,d,5.3
H,57,3.56,d,5.3
H,58,3.4,t,6.2
H,59,3.4,t,6.2
H,60,1.55,tt,"6.6,6.2"
H,61,1.55,tt,"6.6,6.2"
H,62,1.29,m,6.6
H,63,1.29,m,6.6
H,64,1.34,m,6.6
H,65,1.34,m,6.6
H,66,1.28,m,6.6
H,67,1.28,m,6.6
H,68,1.26,m,6.6
H,69,1.26,m,6.6
H,70,1.26,m,6.6
H,71,1.26,m,6.6
H,72,1.26,m,6.6
H,73,1.26,m,6.6
H,74,1.26,m,6.6
H,75,1.26,m,6.6
H,76,1.26,m,6.6
H,77,1.26,m,6.6
H,78,1.26,m,6.6
H,79,1.26,m,6.6
H,80,1.26,m,6.6
H,81,1.26,m,6.6
H,82,1.26,m,6.6
H,83,1.26,m,6.6
H,84,1.28,m,6.6
H,85,1.28,m,6.6
H,86,1.33,m,6.6
H,87,1.33,m,6.6
H,88,1.34,m,6.6
H,89,1.34,m,6.6
H,90,1.52,tt,"6.6,6.2"
H,91,1.52,tt,"6.6,6.2"
H,92,3.54,t,6.2
H,93,3.54,t,6.2
H,94,,,
H,95,4.05,d,5.3
H,96,4.05,d,5.3
H,97,5.18,d,3.8
H,98,4.15,dd,"9.4,3.9"
H,99,4.15,dd,"9.4,1.2"
H,100,4.01,ddd,"3.9,2.8,1.2"
H,101,,,
H,102,4.04,dd,"2.8,0.6"
H,103,,,
H,104,3.88,dd,"3.8,0.6"
H,105,,,
H,106,3.67,dt,"7.1,5.4"
H,107,3.87,d,5.4
H,108,3.87,d,5.4
H,109,,,
H,110,3.61,dd,"7.2,7.1"
H,111,,,
H,112,3.89,dd,"10.9,7.2"
H,113,,,
