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,16,114.35,s,
C,17,144.11,s,
C,18,20.69,s,
C,19,33.95,s,
C,20,19.08,s,
C,21,35.12,s,
C,22,55.37,s,
O,23,,,
C,24,52.9,s,
C,25,76.51,s,
C,26,30.57,s,
C,27,30.57,s,
C,28,83.52,s,
O,29,,,
C,30,108.09,s,
C,31,33.56,s,
C,32,35.22,s,
C,33,80.53,s,
C,34,23.64,s,
O,35,,,
O,36,,,
C,37,74.63,s,
C,38,44.96,s,
C,39,,,
O,40,,,
C,41,40.4,s,
C,42,18.87,s,
C,43,43.37,s,
C,44,,,
O,45,,,
C,46,35.12,s,
C,47,37.2,s,
C,48,14.74,s,
H,49,0.91,t,7.0
H,50,0.91,t,7.0
H,51,0.91,t,7.0
H,52,1.37,qt,"7.0,6.7"
H,53,1.37,qt,"7.0,6.7"
H,54,2.05,t,6.7
H,55,2.05,t,6.7
H,56,,,
H,57,7.06,d,12.0
H,58,6.07,dd,"12.0,11.0"
H,59,6.87,dd,"16.0,11.0"
H,60,5.4,dt,"16.0,7.0"
H,61,2.44,dd,"7.0,6.1"
H,62,2.44,dd,"7.0,6.1"
H,63,4.52,t,6.1
H,64,5.62,s,
H,65,1.9,s,
H,66,1.9,s,
H,67,1.9,s,
H,68,2.31,dqd,"7.0,6.7,2.1"
H,69,1.42,d,6.7
H,70,1.42,d,6.7
H,71,1.42,d,6.7
H,72,1.88,ddd,"12.4,2.1,1.0"
H,73,1.88,ddd,"12.4,9.9,7.0"
H,74,3.36,ddd,"9.9,5.9,1.0"
H,75,4.52,dd,"5.9,2.8"
H,76,4.61,ddd,"9.7,3.5,2.8"
H,77,1.8,m,
H,78,1.8,m,
H,79,1.8,m,
H,80,1.8,m,
H,81,4.54,dd,"11.7,3.2"
H,82,2.02,ddd,"13.9,12.4,4.0"
H,83,2.02,ddd,"12.4,3.9,2.5"
H,84,1.9,ddd,"12.4,4.0,2.5"
H,85,1.9,ddd,"13.9,12.4,3.9"
H,86,1.46,s,
H,87,1.46,s,
H,88,1.46,s,
H,89,4.73,m,
H,90,2.77,dd,"15.4,6.2"
H,91,2.77,dd,"15.4,1.9"
H,92,2.97,dqd,"7.6,6.6,1.2"
H,93,1.13,d,6.6
H,94,1.13,d,6.6
H,95,1.13,d,6.6
H,96,2.74,dd,"15.4,7.6"
H,97,2.74,dd,"15.4,1.2"
H,98,1.88,ddd,"12.4,7.2,1.1"
H,99,1.88,ddd,"12.4,10.4,7.9"
H,100,2.3,dqd,"7.9,6.6,1.1"
H,101,1.1,d,6.6
H,102,1.1,d,6.6
H,103,1.1,d,6.6
