C,1,11.63,s,
C,2,26.21,s,
C,3,35.5,s,
C,4,37.71,s,
C,5,77.48,s,
O,6,,,
C,7,166.77,s,
O,8,,,
C,9,105.45,s,
C,10,184.59,s,
O,11,,,
C,12,41.86,s,
C,13,29.54,s,
C,14,8.66,s,
C,15,49.12,s,
C,16,136.39,s,
C,17,128.9,s,
C,18,47.5,s,
C,19,75.65,s,
O,20,,,
C,21,101.47,s,
C,22,36.76,s,
C,23,71.75,s,
O,24,,,
C,25,59.2,s,
N,26,,,
C,27,160.19,s,
O,28,,,
C,29,143.45,s,
N,30,,,
C,31,121.9,s,
Cl,32,,,
C,33,123.47,s,
C,34,114.94,s,
Cl,35,,,
C,36,74.58,s,
C,37,18.14,s,
O,38,,,
C,39,35.66,s,
C,40,15.22,s,
C,41,32.57,s,
C,42,28.55,s,
C,43,50.54,s,
C,44,28.16,s,
C,45,27.1,s,
C,46,28.84,s,
C,47,30.14,s,
C,48,131.87,s,
C,49,144.6,s,
C,50,41.86,s,
C,51,23.79,s,
C,52,142.69,s,
C,53,129.97,s,
C,54,170.44,s,
O,55,,,
O,56,,,
C,57,196.96,s,
O,58,,,
H,59,0.88,t,7.0
H,60,0.88,t,7.0
H,61,0.88,t,7.0
H,62,1.44,qd,"7.0,6.2"
H,63,1.44,qd,"7.0,6.2"
H,64,3.23,dtd,"11.7,6.2,5.6"
H,65,1.96,dd,"12.4,11.7"
H,66,1.96,dd,"12.4,5.6"
H,67,,,
H,68,1.63,q,7.1
H,69,1.63,q,7.1
H,70,0.77,t,7.1
H,71,0.77,t,7.1
H,72,0.77,t,7.1
H,73,2.3,ddd,"7.8,4.7,0.8"
H,74,6.16,dd,"11.0,4.7"
H,75,6.16,dd,"11.0,2.7"
H,76,2.69,ddd,"12.2,9.5,2.7"
H,77,4.8,dd,"9.5,6.4"
H,78,4.72,dd,"10.8,3.7"
H,79,2.03,ddd,"12.4,11.9,10.8"
H,80,2.03,ddd,"12.4,4.3,3.7"
H,81,4.22,ddd,"11.9,11.3,4.3"
H,82,,,
H,83,3.23,ddd,"11.3,9.7,7.0"
H,84,7.4,d,7.0
H,85,,,
H,86,7.45,s,
H,87,4.92,dq,"9.7,6.1"
H,88,1.3,d,6.1
H,89,1.3,d,6.1
H,90,1.3,d,6.1
H,91,2.08,m,
H,92,1.0,d,6.5
H,93,1.0,d,6.5
H,94,1.0,d,6.5
H,95,1.64,m,
H,96,1.64,m,
H,97,1.68,m,
H,98,1.68,m,
H,99,1.61,ddd,"12.2,11.9,3.9"
H,100,1.58,m,
H,101,1.58,m,
H,102,1.34,m,
H,103,1.34,m,
H,104,1.38,m,
H,105,1.38,m,
H,106,2.07,m,
H,107,2.07,m,
H,108,5.83,dd,"11.5,3.1"
H,109,6.3,s,
H,110,1.13,s,
H,111,1.13,s,
H,112,1.13,s,
H,113,5.99,s,
H,114,,,
