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,14,36.24,s,
C,15,24.66,s,
C,16,22.42,s,
C,17,22.42,s,
N,18,,,
C,19,162.36,s,
O,20,,,
C,21,71.6,s,
C,22,31.68,s,
C,23,127.28,s,
C,24,131.1,s,
C,25,116.7,s,
C,26,158.3,s,
O,27,,,
C,28,116.7,s,
C,29,131.1,s,
N,30,,,
C,31,52.69,s,
C,32,52.69,s,
C,33,52.69,s,
C,34,30.56,s,
C,35,18.38,s,
C,36,18.38,s,
C,37,162.36,s,
O,38,,,
N,39,,,
C,40,145.66,s,
C,41,100.28,s,
C,42,143.45,s,
C,43,137.78,s,
N,44,,,
C,45,135.92,s,
N,46,,,
C,47,171.9,s,
O,48,,,
O,49,,,
H,50,0.8,d,6.4
H,51,0.8,d,6.4
H,52,0.8,d,6.4
H,53,1.67,m,"6.4,5.9"
H,54,0.8,d,6.4
H,55,0.8,d,6.4
H,56,0.8,d,6.4
H,57,1.87,dd,"6.2,5.9"
H,58,1.87,dd,"6.2,5.9"
H,59,4.28,t,6.2
H,60,,,
H,61,4.03,d,5.4
H,62,,,
H,63,4.28,t,6.2
H,64,1.87,dd,"6.2,5.9"
H,65,1.87,dd,"6.2,5.9"
H,66,1.67,m,"6.4,5.9"
H,67,0.8,d,6.4
H,68,0.8,d,6.4
H,69,0.8,d,6.4
H,70,0.8,d,6.4
H,71,0.8,d,6.4
H,72,0.8,d,6.4
H,73,,,
H,74,4.86,t,6.3
H,75,3.45,d,6.3
H,76,3.45,d,6.3
H,77,6.9,ddd,"6.5,1.9,0.5"
H,78,6.55,ddd,"6.5,1.9,0.5"
H,79,,,
H,80,6.55,ddd,"7.2,1.9,0.5"
H,81,6.9,ddd,"7.2,1.9,0.5"
H,82,2.26,s,
H,83,2.26,s,
H,84,2.26,s,
H,85,2.26,s,
H,86,2.26,s,
H,87,2.26,s,
H,88,2.26,s,
H,89,2.26,s,
H,90,2.26,s,
H,91,2.19,m,"6.4,5.4"
H,92,0.82,d,6.4
H,93,0.82,d,6.4
H,94,0.82,d,6.4
H,95,0.82,d,6.4
H,96,0.82,d,6.4
H,97,0.82,d,6.4
H,98,,,
H,99,7.43,s,
H,100,8.78,s,
H,101,9.15,s,
H,102,,,
