C,1,27.77,s,
C,2,72.88,s,
C,3,27.77,s,
O,4,,,
C,5,46.95,s,
C,6,26.4,s,
C,7,35.28,s,
C,8,37.66,s,
C,9,17.35,s,
C,10,50.54,s,
C,11,29.06,s,
C,12,75.84,s,
O,13,,,
C,14,47.72,s,
C,15,17.01,s,
C,16,51.21,s,
C,17,23.21,s,
C,18,22.07,s,
C,19,51.22,s,
C,20,40.3,s,
C,21,18.0,s,
C,22,33.77,s,
C,23,18.17,s,
C,24,55.39,s,
C,25,39.0,s,
C,26,21.96,s,
C,27,21.96,s,
C,28,78.78,s,
O,29,,,
C,30,27.46,s,
C,31,38.78,s,
C,32,37.17,s,
C,33,16.16,s,
H,34,1.22,s,
H,35,1.22,s,
H,36,1.22,s,
H,37,1.22,s,
H,38,1.22,s,
H,39,1.22,s,
H,40,,,
H,41,2.13,ddd,"10.4,9.7,8.4"
H,42,1.58,m,
H,43,1.58,m,
H,44,1.72,ddd,"12.4,5.3,1.4"
H,45,1.72,ddd,"13.3,12.4,6.0"
H,46,1.04,s,
H,47,1.04,s,
H,48,1.04,s,
H,49,1.61,ddd,"10.9,9.7,1.5"
H,50,1.86,ddd,"12.4,11.7,10.9"
H,51,1.86,ddd,"12.4,6.4,1.5"
H,52,4.33,dd,"11.7,6.4"
H,53,,,
H,54,1.37,s,
H,55,1.37,s,
H,56,1.37,s,
H,57,1.57,dd,"13.0,5.0"
H,58,1.27,m,
H,59,1.27,m,
H,60,1.01,m,
H,61,1.01,m,
H,62,1.22,dd,"9.8,9.1"
H,63,1.02,s,
H,64,1.02,s,
H,65,1.02,s,
H,66,1.59,ddd,"12.4,10.6,8.2"
H,67,1.59,ddd,"12.4,8.7,1.8"
H,68,1.46,m,
H,69,1.46,m,
H,70,0.73,dd,"9.8,8.7"
H,71,0.94,s,
H,72,0.94,s,
H,73,0.94,s,
H,74,0.94,s,
H,75,0.94,s,
H,76,0.94,s,
H,77,3.32,dd,"11.0,6.0"
H,78,,,
H,79,1.66,m,
H,80,1.66,m,
H,81,1.29,ddd,"12.4,5.7,2.6"
H,82,1.29,ddd,"12.8,12.4,5.2"
H,83,0.83,s,
H,84,0.83,s,
H,85,0.83,s,
