C,1,22.42,s,
C,2,24.66,s,
C,3,22.42,s,
C,4,36.24,s,
C,5,57.53,s,
N,6,,,
C,7,162.36,s,
O,8,,,
C,9,57.53,s,
N,10,,,
C,11,162.36,s,
O,12,,,
C,13,57.53,s,
C,14,35.29,s,
C,15,110.16,s,
C,16,123.99,s,
N,17,,,
C,18,136.38,s,
C,19,111.5,s,
C,20,121.51,s,
C,21,119.23,s,
C,22,118.5,s,
C,23,127.47,s,
N,24,,,
C,25,41.56,s,
C,26,41.56,s,
C,27,82.0,s,
C,28,28.75,s,
C,29,17.55,s,
C,30,17.55,s,
O,31,,,
C,32,155.95,s,
C,33,122.37,s,
C,34,129.42,s,
C,35,132.65,s,
C,36,129.42,s,
C,37,122.37,s,
C,38,121.45,s,
C,39,149.45,s,
N,40,,,
C,41,162.36,s,
O,42,,,
H,43,0.8,d,6.4
H,44,0.8,d,6.4
H,45,0.8,d,6.4
H,46,1.67,m,"6.4,5.9"
H,47,0.8,d,6.4
H,48,0.8,d,6.4
H,49,0.8,d,6.4
H,50,1.87,dd,"6.2,5.9"
H,51,1.87,dd,"6.2,5.9"
H,52,4.28,t,6.2
H,53,,,
H,54,4.6,d,5.9
H,55,,,
H,56,4.28,t,6.3
H,57,3.01,d,6.3
H,58,3.01,d,6.3
H,59,7.11,d,0.5
H,60,,,
H,61,7.34,ddd,"6.7,1.4,0.5"
H,62,7.14,ddd,"7.5,6.7,1.4"
H,63,7.01,ddd,"7.6,7.5,1.4"
H,64,7.57,ddt,"7.6,1.4,0.5"
H,65,2.38,s,
H,66,2.38,s,
H,67,2.38,s,
H,68,2.38,s,
H,69,2.38,s,
H,70,2.38,s,
H,71,5.47,dd,"5.9,5.0"
H,72,1.87,m,"6.4,5.0"
H,73,0.94,d,6.4
H,74,0.94,d,6.4
H,75,0.94,d,6.4
H,76,0.94,d,6.4
H,77,0.94,d,6.4
H,78,0.94,d,6.4
H,79,6.93,ddd,"25.5,1.9,0.5"
H,80,7.31,ddd,"25.5,1.9,0.5"
H,81,7.31,ddd,"26.1,1.9,0.5"
H,82,6.93,ddd,"26.1,1.9,0.5"
H,83,5.91,s,
H,84,7.06,s,
H,85,,,
