C,1,11.31,s,
C,2,24.89,s,
C,3,40.4,s,
C,4,18.87,s,
C,5,57.53,s,
N,6,,,
C,7,162.36,s,
O,8,,,
C,9,57.53,s,
C,10,76.59,s,
C,11,33.14,s,
C,12,49.76,s,
N,13,,,
C,14,169.5,s,
O,15,,,
C,16,57.53,s,
C,17,32.8,s,
C,18,110.16,s,
C,19,123.99,s,
N,20,,,
C,21,136.38,s,
C,22,111.5,s,
C,23,121.51,s,
C,24,119.23,s,
C,25,118.5,s,
C,26,127.47,s,
N,27,,,
C,28,162.36,s,
O,29,,,
C,30,57.53,s,
C,31,36.24,s,
C,32,24.66,s,
C,33,22.42,s,
C,34,22.42,s,
N,35,,,
C,36,41.56,s,
C,37,41.56,s,
O,38,,,
C,39,156.82,s,
C,40,121.28,s,
C,41,129.42,s,
C,42,132.65,s,
C,43,129.42,s,
C,44,121.28,s,
C,45,121.45,s,
C,46,149.45,s,
N,47,,,
C,48,162.36,s,
O,49,,,
H,50,0.85,t,7.0
H,51,0.85,t,7.0
H,52,0.85,t,7.0
H,53,1.33,qd,"7.0,6.0"
H,54,1.33,qd,"7.0,6.0"
H,55,2.83,qtd,"6.5,6.0,5.5"
H,56,1.03,d,6.5
H,57,1.03,d,6.5
H,58,1.03,d,6.5
H,59,4.03,d,5.5
H,60,,,
H,61,4.28,d,5.5
H,62,4.89,ddd,"9.7,5.5,4.0"
H,63,2.11,m,
H,64,2.11,m,
H,65,3.48,ddd,"12.4,12.1,4.6"
H,66,3.48,ddd,"12.4,11.8,4.9"
H,67,3.58,t,6.2
H,68,3.5,d,6.2
H,69,3.5,d,6.2
H,70,7.11,d,0.5
H,71,,,
H,72,7.34,ddd,"7.1,1.4,0.5"
H,73,7.14,ddd,"7.6,7.1,1.4"
H,74,7.01,ddd,"7.6,7.3,1.4"
H,75,7.57,ddt,"7.3,1.4,0.5"
H,76,,,
H,77,4.28,t,6.2
H,78,1.87,dd,"6.2,5.9"
H,79,1.87,dd,"6.2,5.9"
H,80,1.67,m,"6.4,5.9"
H,81,0.8,d,6.4
H,82,0.8,d,6.4
H,83,0.8,d,6.4
H,84,0.8,d,6.4
H,85,0.8,d,6.4
H,86,0.8,d,6.4
H,87,2.38,s,
H,88,2.38,s,
H,89,2.38,s,
H,90,2.38,s,
H,91,2.38,s,
H,92,2.38,s,
H,93,6.93,ddd,"22.3,1.9,0.5"
H,94,7.31,ddd,"22.3,1.9,0.5"
H,95,7.31,ddd,"23.1,1.9,0.5"
H,96,6.93,ddd,"23.1,1.9,0.5"
H,97,5.91,s,
H,98,7.06,s,
H,99,,,
