C,1,13.92,s,
C,2,21.62,s,
C,3,30.1,s,
C,4,162.36,s,
O,5,,,
N,6,,,
C,7,57.53,s,
C,8,169.5,s,
O,9,,,
N,10,,,
C,11,47.47,s,
C,12,24.42,s,
C,13,28.74,s,
C,14,58.57,s,
C,15,171.67,s,
O,16,,,
N,17,,,
C,18,31.45,s,
C,19,57.53,s,
C,20,35.29,s,
C,21,134.98,s,
C,22,129.1,s,
C,23,128.8,s,
C,24,126.94,s,
C,25,128.8,s,
C,26,129.1,s,
C,27,162.36,s,
O,28,,,
N,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,
C,35,169.5,s,
O,36,,,
N,37,,,
C,38,30.17,s,
C,39,58.23,s,
C,40,170.65,s,
O,41,,,
N,42,,,
C,43,37.1,s,
C,44,60.7,s,
C,45,168.57,s,
N,46,,,
C,47,143.12,s,
C,48,120.38,s,
S,49,,,
C,50,26.49,s,
C,51,18.59,s,
C,52,18.59,s,
C,53,30.56,s,
C,54,18.38,s,
C,55,18.38,s,
H,56,0.91,t,7.0
H,57,0.91,t,7.0
H,58,0.91,t,7.0
H,59,1.37,qt,"7.0,6.7"
H,60,1.37,qt,"7.0,6.7"
H,61,2.05,t,6.7
H,62,2.05,t,6.7
H,63,,,
H,64,5.02,d,5.3
H,65,3.7,ddd,"12.4,10.6,1.6"
H,66,3.7,ddd,"12.4,10.2,8.9"
H,67,2.22,m,
H,68,2.22,m,
H,69,1.9,m,
H,70,1.9,m,
H,71,4.68,dd,"8.8,0.9"
H,72,2.91,s,
H,73,2.91,s,
H,74,2.91,s,
H,75,4.28,t,6.6
H,76,3.01,d,6.6
H,77,3.01,d,6.6
H,78,7.25,m,
H,79,7.24,m,
H,80,7.22,ddt,"7.7,6.6,1.4"
H,81,7.24,m,
H,82,7.25,m,
H,83,,,
H,84,3.58,t,6.1
H,85,1.87,dd,"6.1,5.9"
H,86,1.87,dd,"6.1,5.9"
H,87,1.67,m,"6.4,5.9"
H,88,0.8,d,6.4
H,89,0.8,d,6.4
H,90,0.8,d,6.4
H,91,0.8,d,6.4
H,92,0.8,d,6.4
H,93,0.8,d,6.4
H,94,2.99,s,
H,95,2.99,s,
H,96,2.99,s,
H,97,5.08,d,5.7
H,98,3.24,s,
H,99,3.24,s,
H,100,3.24,s,
H,101,3.58,s,
H,102,3.58,s,
H,103,7.74,d,2.5
H,104,7.37,d,2.5
H,105,2.32,m,"6.4,5.7"
H,106,0.85,d,6.4
H,107,0.85,d,6.4
H,108,0.85,d,6.4
H,109,0.85,d,6.4
H,110,0.85,d,6.4
H,111,0.85,d,6.4
H,112,2.09,m,"6.4,5.3"
H,113,0.88,d,6.4
H,114,0.88,d,6.4
H,115,0.88,d,6.4
H,116,0.88,d,6.4
H,117,0.88,d,6.4
H,118,0.88,d,6.4
