C,1,114.35,s,
C,2,142.45,s,
C,3,55.78,s,
C,4,31.44,s,
C,5,31.44,s,
N,6,,,
C,7,57.53,s,
C,8,35.29,s,
C,9,134.98,s,
C,10,129.1,s,
C,11,128.8,s,
C,12,126.94,s,
C,13,128.8,s,
C,14,129.1,s,
C,15,162.36,s,
O,16,,,
N,17,,,
C,18,57.53,s,
C,19,32.8,s,
C,20,134.98,s,
C,21,129.1,s,
C,22,128.8,s,
C,23,126.94,s,
C,24,128.8,s,
C,25,129.1,s,
C,26,169.5,s,
O,27,,,
N,28,,,
C,29,47.03,s,
C,30,23.68,s,
C,31,29.71,s,
C,32,57.53,s,
C,33,162.36,s,
O,34,,,
N,35,,,
C,36,57.53,s,
C,37,168.37,s,
N,38,,,
C,39,147.76,s,
C,40,162.87,s,
O,41,,,
O,42,,,
C,43,52.28,s,
C,44,127.07,s,
S,45,,,
C,46,30.56,s,
C,47,18.38,s,
C,48,18.38,s,
H,49,5.26,dd,"16.0,2.5"
H,50,5.26,dd,"12.0,2.5"
H,51,6.04,dd,"16.0,12.0"
H,52,1.18,s,
H,53,1.18,s,
H,54,1.18,s,
H,55,1.18,s,
H,56,1.18,s,
H,57,1.18,s,
H,58,,,
H,59,4.64,t,6.2
H,60,3.01,d,6.2
H,61,3.01,d,6.2
H,62,7.25,m,
H,63,7.24,m,
H,64,7.22,ddt,"8.0,7.6,1.4"
H,65,7.24,m,
H,66,7.25,m,
H,67,,,
H,68,3.58,t,6.2
H,69,3.5,d,6.2
H,70,3.5,d,6.2
H,71,7.25,m,
H,72,7.24,m,
H,73,7.22,ddt,"7.9,7.6,1.4"
H,74,7.24,m,
H,75,7.25,m,
H,76,3.7,ddd,"12.4,12.3,8.0"
H,77,3.7,ddd,"12.4,8.6,0.4"
H,78,1.9,m,
H,79,1.9,m,
H,80,1.84,m,
H,81,1.84,m,
H,82,4.28,dd,"7.8,0.5"
H,83,,,
H,84,4.28,d,5.3
H,85,3.96,s,
H,86,3.96,s,
H,87,3.96,s,
H,88,7.82,s,
H,89,2.09,m,"6.4,5.3"
H,90,0.88,d,6.4
H,91,0.88,d,6.4
H,92,0.88,d,6.4
H,93,0.88,d,6.4
H,94,0.88,d,6.4
H,95,0.88,d,6.4
