H,1,,,
N,2,,,
C,3,162.36,s,
O,4,,,
C,5,73.63,s,
O,6,,,
C,7,30.5,s,
C,8,57.53,s,
N,9,,,
C,10,162.36,s,
O,11,,,
C,12,57.53,s,
C,13,63.7,s,
O,14,,,
N,15,,,
C,16,162.36,s,
O,17,,,
C,18,57.53,s,
C,19,36.24,s,
C,20,24.66,s,
C,21,22.42,s,
C,22,22.42,s,
N,23,,,
C,24,162.36,s,
O,25,,,
C,26,57.53,s,
N,27,,,
C,28,29.71,s,
C,29,30.43,s,
C,30,169.51,s,
O,31,,,
O,32,,,
C,33,171.36,s,
O,34,,,
C,35,57.53,s,
C,36,39.16,s,
S,37,,,
S,38,,,
C,39,39.16,s,
C,40,57.53,s,
N,41,,,
C,42,162.36,s,
O,43,,,
C,44,57.53,s,
C,45,29.77,s,
C,46,26.61,s,
C,47,29.21,s,
C,48,29.42,s,
C,49,29.37,s,
C,50,31.8,s,
C,51,22.67,s,
C,52,14.08,s,
N,53,,,
C,54,162.36,s,
O,55,,,
C,56,162.36,s,
O,57,,,
N,58,,,
H,59,,,
H,60,4.52,t,6.0
H,61,,,
H,62,2.05,dd,"6.2,6.0"
H,63,2.05,dd,"6.2,6.0"
H,64,4.28,t,6.2
H,65,,,
H,66,4.28,t,5.8
H,67,3.74,d,5.8
H,68,3.74,d,5.8
H,69,,,
H,70,,,
H,71,4.28,t,6.2
H,72,1.87,dd,"6.2,5.9"
H,73,1.87,dd,"6.2,5.9"
H,74,1.67,m,"6.4,5.9"
H,75,0.8,d,6.4
H,76,0.8,d,6.4
H,77,0.8,d,6.4
H,78,0.8,d,6.4
H,79,0.8,d,6.4
H,80,0.8,d,6.4
H,81,,,
H,82,4.28,dd,"12.3,3.5"
H,83,,,
H,84,,,
H,85,1.84,m,
H,86,1.84,m,
H,87,2.1,ddd,"15.4,13.2,2.1"
H,88,2.1,ddd,"15.4,13.8,6.1"
H,89,4.28,dd,"9.9,7.5"
H,90,3.27,dd,"12.4,7.5"
H,91,3.27,dd,"12.4,9.9"
H,92,3.27,dd,"12.4,5.1"
H,93,3.27,dd,"12.6,12.4"
H,94,4.28,dd,"12.6,5.1"
H,95,,,
H,96,4.28,t,6.1
H,97,1.41,td,"6.6,6.1"
H,98,1.41,td,"6.6,6.1"
H,99,1.37,m,6.6
H,100,1.37,m,6.6
H,101,1.27,m,6.6
H,102,1.27,m,6.6
H,103,1.26,m,6.6
H,104,1.26,m,6.6
H,105,1.26,m,6.6
H,106,1.26,m,6.6
H,107,1.27,tt,"6.6,6.5"
H,108,1.27,tt,"6.6,6.5"
H,109,1.27,qt,"7.0,6.5"
H,110,1.27,qt,"7.0,6.5"
H,111,0.88,t,7.0
H,112,0.88,t,7.0
H,113,0.88,t,7.0
H,114,,,
H,115,,,
