C,1,13.05,s,
C,2,49.16,s,
C,3,71.36,s,
O,4,,,
S,5,,,
O,6,,,
O,7,,,
O,8,,,
C,9,,,
O,10,,,
C,11,38.24,s,
C,12,28.16,s,
C,13,36.13,s,
C,14,18.86,s,
C,15,56.93,s,
C,16,29.4,s,
C,17,24.9,s,
C,18,51.8,s,
C,19,40.8,s,
C,20,40.7,s,
C,21,22.4,s,
C,22,40.8,s,
C,23,43.9,s,
C,24,12.8,s,
C,25,38.86,s,
C,26,21.19,s,
C,27,35.28,s,
C,28,29.71,s,
C,29,55.3,s,
N,30,,,
C,31,45.37,s,
C,32,24.57,s,
C,33,47.88,s,
N,34,,,
C,35,49.43,s,
C,36,27.13,s,
C,37,27.4,s,
C,38,41.45,s,
N,39,,,
C,40,36.24,s,
C,41,43.47,s,
C,42,35.82,s,
C,43,68.7,s,
O,44,,,
H,45,1.13,d,6.6
H,46,1.13,d,6.6
H,47,1.13,d,6.6
H,48,2.69,qt,"6.6,5.8"
H,49,4.28,d,5.8
H,50,4.28,d,5.8
H,51,,,
H,52,2.67,t,6.7
H,53,2.67,t,6.7
H,54,1.58,td,"6.7,6.0"
H,55,1.58,td,"6.7,6.0"
H,56,1.37,qtd,"6.5,6.0,5.6"
H,57,0.89,d,6.5
H,58,0.89,d,6.5
H,59,0.89,d,6.5
H,60,0.95,ddd,"10.8,6.8,5.6"
H,61,1.63,m,
H,62,1.63,m,
H,63,1.48,m,
H,64,1.48,m,
H,65,1.61,ddd,"11.9,10.3,5.3"
H,66,2.4,ddd,"11.2,10.3,3.0"
H,67,0.84,ddd,"12.3,11.2,4.5"
H,68,1.54,m,
H,69,1.54,m,
H,70,1.77,ddd,"14.0,12.4,3.4"
H,71,1.77,ddd,"12.4,5.6,2.9"
H,72,0.7,s,
H,73,0.7,s,
H,74,0.7,s,
H,75,0.98,s,
H,76,0.98,s,
H,77,0.98,s,
H,78,1.72,ddd,"13.4,12.4,4.3"
H,79,1.72,ddd,"12.4,4.0,2.7"
H,80,1.84,m,
H,81,1.84,m,
H,82,3.64,m,
H,83,,,
H,84,2.65,t,6.4
H,85,2.65,t,6.4
H,86,1.8,m,6.4
H,87,1.8,m,6.4
H,88,2.69,t,6.4
H,89,2.69,t,6.4
H,90,,,
H,91,2.71,t,6.4
H,92,2.71,t,6.4
H,93,1.48,tt,"6.6,6.4"
H,94,1.48,tt,"6.6,6.4"
H,95,1.71,tt,"6.6,6.5"
H,96,1.71,tt,"6.6,6.5"
H,97,2.81,t,6.5
H,98,2.81,t,6.5
H,99,,,
H,100,,,
H,101,1.87,dt,"12.4,3.5"
H,102,1.87,ddd,"12.6,12.4,11.6"
H,103,1.44,m,
H,104,1.88,ddd,"12.4,11.5,4.4"
H,105,1.88,ddd,"12.4,5.3,2.4"
H,106,3.92,ddd,"4.4,3.0,2.4"
H,107,,,
