C,1,17.37,s,
C,2,32.04,s,
C,3,17.37,s,
C,4,81.41,s,
C,5,30.57,s,
C,6,33.95,s,
C,7,36.13,s,
C,8,18.86,s,
C,9,47.88,s,
C,10,28.19,s,
C,11,23.66,s,
C,12,42.31,s,
C,13,39.81,s,
C,14,31.78,s,
C,15,28.71,s,
C,16,73.11,s,
O,17,,,
C,18,46.97,s,
C,19,12.8,s,
C,20,35.6,s,
C,21,19.24,s,
C,22,37.6,s,
C,23,29.71,s,
C,24,55.3,s,
N,25,,,
C,26,45.37,s,
C,27,24.57,s,
C,28,47.88,s,
N,29,,,
C,30,49.43,s,
C,31,27.13,s,
C,32,27.4,s,
C,33,41.45,s,
N,34,,,
C,35,36.24,s,
C,36,43.47,s,
C,37,36.25,s,
C,38,67.35,s,
O,39,,,
O,40,,,
S,41,,,
O,42,,,
O,43,,,
O,44,,,
H,45,0.75,d,6.4
H,46,0.75,d,6.4
H,47,0.75,d,6.4
H,48,1.85,m,"6.4,4.9"
H,49,0.75,d,6.4
H,50,0.75,d,6.4
H,51,0.75,d,6.4
H,52,4.57,td,"5.7,4.9"
H,53,1.8,td,"6.7,5.7"
H,54,1.8,td,"6.7,5.7"
H,55,1.49,td,"6.7,6.0"
H,56,1.49,td,"6.7,6.0"
H,57,1.37,qtd,"6.5,6.0,5.6"
H,58,0.89,d,6.5
H,59,0.89,d,6.5
H,60,0.89,d,6.5
H,61,1.85,ddd,"13.1,5.6,5.2"
H,62,1.59,m,
H,63,1.59,m,
H,64,1.45,m,
H,65,1.45,m,
H,66,1.94,ddd,"8.4,7.6,0.9"
H,67,1.48,ddd,"9.5,7.6,4.5"
H,68,1.68,ddd,"9.2,8.5,4.5"
H,69,1.63,ddd,"12.4,8.5,8.3"
H,70,1.63,ddd,"12.4,9.2,1.8"
H,71,3.94,dd,"8.3,1.8"
H,72,,,
H,73,0.7,s,
H,74,0.7,s,
H,75,0.7,s,
H,76,0.88,s,
H,77,0.88,s,
H,78,0.88,s,
H,79,1.72,ddd,"12.4,12.0,7.8"
H,80,1.72,ddd,"12.4,7.1,1.8"
H,81,1.84,m,
H,82,1.84,m,
H,83,3.64,m,
H,84,,,
H,85,2.65,t,6.4
H,86,2.65,t,6.4
H,87,1.8,m,6.4
H,88,1.8,m,6.4
H,89,2.69,t,6.4
H,90,2.69,t,6.4
H,91,,,
H,92,2.71,t,6.4
H,93,2.71,t,6.4
H,94,1.48,tt,"6.6,6.4"
H,95,1.48,tt,"6.6,6.4"
H,96,1.71,tt,"6.6,6.5"
H,97,1.71,tt,"6.6,6.5"
H,98,2.81,t,6.5
H,99,2.81,t,6.5
H,100,,,
H,101,,,
H,102,1.87,ddd,"12.4,5.6,4.8"
H,103,1.87,ddd,"12.8,12.4,9.7"
H,104,1.44,m,
H,105,1.38,ddd,"12.4,9.1,8.8"
H,106,1.38,ddd,"12.4,8.3,7.8"
H,107,3.79,ddd,"9.5,9.1,7.8"
H,108,,,
H,109,,,
