C,1,11.09,s,
C,2,24.8,s,
C,3,30.26,s,
C,4,14.93,s,
C,5,57.04,s,
C,6,169.5,s,
O,7,,,
N,8,,,
C,9,47.03,s,
C,10,23.68,s,
C,11,29.71,s,
C,12,57.53,s,
C,13,162.36,s,
O,14,,,
N,15,,,
C,16,57.97,s,
C,17,39.9,s,
C,18,134.98,s,
C,19,130.49,s,
C,20,115.71,s,
C,21,156.27,s,
O,22,,,
C,23,115.71,s,
C,24,130.49,s,
C,25,170.3,s,
O,26,,,
O,27,,,
N,28,,,
C,29,30.17,s,
C,30,169.5,s,
O,31,,,
C,32,57.53,s,
C,33,32.8,s,
C,34,134.98,s,
C,35,130.49,s,
C,36,115.71,s,
C,37,156.27,s,
O,38,,,
C,39,115.71,s,
C,40,130.49,s,
N,41,,,
C,42,162.36,s,
O,43,,,
C,44,73.63,s,
O,45,,,
C,46,57.53,s,
N,47,,,
C,48,29.71,s,
C,49,24.68,s,
C,50,29.06,s,
C,51,29.05,s,
C,52,27.06,s,
C,53,32.86,s,
C,54,44.93,s,
Cl,55,,,
H,56,0.9,t,7.0
H,57,0.9,t,7.0
H,58,0.9,t,7.0
H,59,1.37,qd,"7.0,6.0"
H,60,1.37,qd,"7.0,6.0"
H,61,2.15,qtd,"6.5,6.0,5.7"
H,62,0.86,d,6.5
H,63,0.86,d,6.5
H,64,0.86,d,6.5
H,65,5.19,d,5.7
H,66,3.7,ddd,"12.4,11.7,9.4"
H,67,3.7,ddd,"12.4,7.4,0.7"
H,68,1.9,m,
H,69,1.9,m,
H,70,1.84,m,
H,71,1.84,m,
H,72,4.28,dd,"13.9,5.9"
H,73,,,
H,74,4.15,t,6.2
H,75,3.5,d,6.2
H,76,3.5,d,6.2
H,77,7.03,ddd,"8.8,1.9,0.5"
H,78,6.69,ddd,"8.8,1.9,0.5"
H,79,,,
H,80,6.69,ddd,"6.2,1.9,0.5"
H,81,7.03,ddd,"6.2,1.9,0.5"
H,82,,,
H,83,2.99,s,
H,84,2.99,s,
H,85,2.99,s,
H,86,3.58,t,6.2
H,87,3.5,d,6.2
H,88,3.5,d,6.2
H,89,7.03,ddd,"7.5,1.9,0.5"
H,90,6.69,ddd,"7.5,1.9,0.5"
H,91,,,
H,92,6.69,ddd,"6.8,1.9,0.5"
H,93,7.03,ddd,"6.8,1.9,0.5"
H,94,,,
H,95,4.52,d,5.3
H,96,,,
H,97,4.28,td,"6.0,5.3"
H,98,,,
H,99,,,
H,100,1.84,td,"6.6,6.0"
H,101,1.84,td,"6.6,6.0"
H,102,1.29,m,6.6
H,103,1.29,m,6.6
H,104,1.32,m,6.6
H,105,1.32,m,6.6
H,106,1.27,m,6.6
H,107,1.27,m,6.6
H,108,1.5,tt,"6.6,6.5"
H,109,1.5,tt,"6.6,6.5"
H,110,1.77,tt,"6.5,6.4"
H,111,1.77,tt,"6.5,6.4"
H,112,3.53,t,6.4
H,113,3.53,t,6.4
