C,1,20.7,s,
C,2,170.2,s,
O,3,,,
O,4,,,
C,5,75.6,s,
C,6,41.1,s,
C,7,83.6,s,
O,8,,,
C,9,41.8,s,
C,10,21.1,s,
C,11,26.9,s,
C,12,36.7,s,
C,13,30.3,s,
C,14,77.7,s,
O,15,,,
C,16,99.8,s,
O,17,,,
C,18,70.23,s,
C,19,17.8,s,
C,20,87.53,s,
O,21,,,
C,22,102.83,s,
O,23,,,
C,24,78.3,s,
C,25,62.49,s,
O,26,,,
C,27,71.65,s,
O,28,,,
C,29,78.4,s,
O,30,,,
C,31,75.1,s,
O,32,,,
C,33,74.02,s,
O,34,,,
C,35,74.46,s,
O,36,,,
C,37,27.0,s,
C,38,30.5,s,
C,39,35.4,s,
C,40,23.8,s,
C,41,35.7,s,
C,42,21.6,s,
C,43,39.1,s,
C,44,50.4,s,
C,45,16.2,s,
C,46,75.3,s,
C,47,169.8,s,
C,48,121.5,s,
C,49,174.2,s,
O,50,,,
O,51,,,
C,52,76.2,s,
H,53,2.02,s,
H,54,2.02,s,
H,55,2.02,s,
H,56,5.68,ddd,"9.0,8.9,7.8"
H,57,2.81,dd,"12.4,9.0"
H,58,2.81,dd,"12.4,7.8"
H,59,,,
H,60,2.13,ddd,"12.6,11.3,3.9"
H,61,1.48,m,
H,62,1.48,m,
H,63,1.48,m,
H,64,1.48,m,
H,65,1.09,m,
H,66,1.51,ddd,"12.4,9.3,1.0"
H,67,1.51,ddd,"12.4,9.3,6.0"
H,68,3.98,m,
H,69,5.09,d,3.1
H,70,4.2,dq,"7.8,6.1"
H,71,1.49,d,6.1
H,72,1.49,d,6.1
H,73,1.49,d,6.1
H,74,3.92,dd,"7.8,3.3"
H,75,4.53,d,1.2
H,76,3.63,dt,"8.4,5.4"
H,77,4.04,d,5.4
H,78,4.04,d,5.4
H,79,,,
H,80,3.82,dd,"8.4,7.2"
H,81,,,
H,82,3.85,dd,"7.2,3.0"
H,83,,,
H,84,3.23,dd,"3.0,1.2"
H,85,,,
H,86,4.38,dd,"4.7,3.3"
H,87,,,
H,88,4.25,dd,"4.7,3.1"
H,89,,,
H,90,1.74,ddt,"12.4,8.6,3.8"
H,91,1.74,m,
H,92,1.37,ddd,"14.2,12.4,3.8"
H,93,1.37,ddd,"12.4,5.4,3.8"
H,94,0.88,s,
H,95,0.88,s,
H,96,0.88,s,
H,97,1.61,ddd,"11.9,11.3,1.3"
H,98,1.47,m,
H,99,1.47,m,
H,100,1.48,ddd,"12.4,4.6,2.4"
H,101,1.48,ddd,"13.5,12.4,3.6"
H,102,1.07,s,
H,103,1.07,s,
H,104,1.07,s,
H,105,3.38,d,8.9
H,106,6.28,s,
H,107,5.32,s,
H,108,5.32,s,
