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,7,149.45,s,
C,8,108.77,s,
C,9,133.3,s,
C,10,132.39,s,
C,11,33.8,s,
C,12,76.49,s,
O,13,,,
C,14,166.9,s,
O,15,,,
C,16,115.36,s,
C,17,152.14,s,
C,18,15.33,s,
C,19,77.48,s,
C,20,25.81,s,
O,21,,,
C,22,74.89,s,
O,23,,,
C,24,56.25,s,
O,25,,,
C,26,58.0,s,
C,27,76.51,s,
C,28,30.57,s,
C,29,30.57,s,
C,30,83.52,s,
O,31,,,
C,32,108.09,s,
C,33,33.56,s,
C,34,35.22,s,
C,35,80.53,s,
C,36,23.64,s,
O,37,,,
O,38,,,
C,39,74.63,s,
C,40,44.96,s,
C,41,,,
O,42,,,
C,43,40.4,s,
C,44,18.87,s,
C,45,43.37,s,
C,46,,,
O,47,,,
C,48,35.12,s,
C,49,37.2,s,
C,50,14.74,s,
H,51,0.91,t,7.0
H,52,0.91,t,7.0
H,53,0.91,t,7.0
H,54,1.37,qt,"7.0,6.7"
H,55,1.37,qt,"7.0,6.7"
H,56,2.05,t,6.7
H,57,2.05,t,6.7
H,58,,,
H,59,7.06,d,12.0
H,60,6.07,dd,"12.0,11.0"
H,61,6.87,dd,"16.0,11.0"
H,62,5.4,dt,"16.0,7.0"
H,63,2.44,dd,"7.0,6.1"
H,64,2.44,dd,"7.0,6.1"
H,65,4.52,t,6.1
H,66,5.89,s,
H,67,2.09,s,
H,68,2.09,s,
H,69,2.09,s,
H,70,1.4,s,
H,71,1.4,s,
H,72,1.4,s,
H,73,,,
H,74,4.12,d,1.3
H,75,,,
H,76,2.71,dd,"6.2,1.3"
H,77,3.77,dd,"6.7,6.2"
H,78,4.61,ddd,"10.8,6.7,5.8"
H,79,1.8,m,
H,80,1.8,m,
H,81,1.8,m,
H,82,1.8,m,
H,83,4.54,dd,"10.4,5.7"
H,84,2.02,ddd,"12.4,9.3,1.2"
H,85,2.02,ddd,"12.4,10.0,9.4"
H,86,1.9,ddd,"12.4,10.0,9.3"
H,87,1.9,ddd,"12.4,9.4,1.2"
H,88,1.46,s,
H,89,1.46,s,
H,90,1.46,s,
H,91,4.73,m,
H,92,2.77,dd,"15.4,5.9"
H,93,2.77,dd,"15.4,2.1"
H,94,2.97,dqd,"7.8,6.6,1.3"
H,95,1.13,d,6.6
H,96,1.13,d,6.6
H,97,1.13,d,6.6
H,98,2.74,dd,"15.4,7.8"
H,99,2.74,dd,"15.4,1.3"
H,100,1.88,ddd,"12.4,9.3,6.6"
H,101,1.88,ddd,"12.4,9.3,8.4"
H,102,2.3,ddq,"9.3,8.4,6.6"
H,103,1.1,d,6.6
H,104,1.1,d,6.6
H,105,1.1,d,6.6
