C,1,11.84,s,
C,2,25.14,s,
C,3,36.97,s,
C,4,14.78,s,
C,5,57.72,s,
N,6,,,
C,7,168.97,s,
O,8,,,
C,9,42.38,s,
N,10,,,
C,11,170.65,s,
O,12,,,
C,13,54.78,s,
C,14,35.29,s,
C,15,130.1,s,
C,16,153.15,s,
N,17,,,
C,18,137.2,s,
C,19,96.49,s,
C,20,158.8,s,
O,21,,,
C,22,112.11,s,
C,23,120.3,s,
C,24,127.21,s,
S,25,,,
O,26,,,
C,27,54.9,s,
C,28,57.53,s,
N,29,,,
C,30,168.97,s,
O,31,,,
C,32,42.24,s,
N,33,,,
C,34,171.4,s,
O,35,,,
C,36,171.19,s,
O,37,,,
N,38,,,
C,39,53.22,s,
C,40,37.7,s,
C,41,175.1,s,
O,42,,,
O,43,,,
C,44,171.17,s,
O,45,,,
N,46,,,
C,47,54.53,s,
C,48,68.02,s,
O,49,,,
C,50,34.25,s,
C,51,55.0,s,
C,52,171.56,s,
O,53,,,
N,54,,,
C,55,57.43,s,
C,56,36.57,s,
C,57,10.06,s,
C,58,73.47,s,
O,59,,,
C,60,62.75,s,
O,61,,,
C,62,171.86,s,
O,63,,,
N,64,,,
H,65,0.84,t,7.0
H,66,0.84,t,7.0
H,67,0.84,t,7.0
H,68,1.54,qd,"7.0,6.0"
H,69,1.54,qd,"7.0,6.0"
H,70,2.05,qtd,"6.5,6.0,5.5"
H,71,0.93,d,6.5
H,72,0.93,d,6.5
H,73,0.93,d,6.5
H,74,4.4,dd,"7.0,5.5"
H,75,7.86,d,7.0
H,76,3.78,d,7.0
H,77,3.78,d,7.0
H,78,8.86,t,7.0
H,79,4.64,ddd,"10.8,7.0,2.4"
H,80,3.01,dd,"15.4,2.4"
H,81,3.01,dd,"15.4,10.8"
H,82,,,
H,83,7.0,dd,"1.9,0.5"
H,84,,,
H,85,6.84,dd,"7.8,1.9"
H,86,7.55,dd,"7.8,0.5"
H,87,3.37,dd,"12.4,10.9"
H,88,3.37,dd,"12.4,8.4"
H,89,4.28,ddd,"10.9,8.4,7.0"
H,90,7.4,d,7.0
H,91,3.8,d,7.0
H,92,3.8,d,7.0
H,93,8.17,t,7.0
H,94,8.13,d,7.0
H,95,4.42,dt,"7.0,6.4"
H,96,2.59,d,6.4
H,97,2.59,d,6.4
H,98,,,
H,99,3.69,dd,"12.4,1.9"
H,100,3.69,dd,"12.4,2.7"
H,101,4.11,m,
H,102,,,
H,103,2.45,ddd,"12.4,6.8,5.8"
H,104,2.45,ddd,"12.4,11.0,1.0"
H,105,4.49,dd,"11.0,5.8"
H,106,8.05,d,7.0
H,107,4.45,dd,"7.0,5.6"
H,108,2.3,qdd,"6.6,5.6,5.0"
H,109,1.0,d,6.6
H,110,1.0,d,6.6
H,111,1.0,d,6.6
H,112,4.41,td,"5.4,5.0"
H,113,,,
H,114,3.87,d,5.4
H,115,3.87,d,5.4
H,116,,,
H,117,7.22,d,7.0
