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,8,37.91,s,
C,9,16.96,s,
C,10,54.73,s,
C,11,72.59,s,
O,12,,,
C,13,43.26,s,
C,14,45.8,s,
C,15,17.2,s,
C,16,48.86,s,
C,17,21.5,s,
C,18,22.07,s,
C,19,51.05,s,
C,20,37.05,s,
C,21,15.97,s,
C,22,38.78,s,
C,23,27.46,s,
C,24,78.78,s,
O,25,,,
C,26,39.0,s,
C,27,21.96,s,
C,28,21.96,s,
C,29,55.39,s,
C,30,18.22,s,
C,31,33.91,s,
C,32,41.5,s,
C,33,16.09,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,"11.2,9.6,8.2"
H,42,1.58,m,
H,43,1.58,m,
H,44,1.72,ddd,"12.4,11.1,7.8"
H,45,1.72,ddd,"12.4,10.9,2.6"
H,46,0.94,s,
H,47,0.94,s,
H,48,0.94,s,
H,49,1.86,dd,"11.2,9.6"
H,50,4.19,ddd,"9.6,8.4,6.8"
H,51,,,
H,52,1.76,dd,"12.4,6.8"
H,53,1.76,dd,"12.4,8.4"
H,54,1.26,s,
H,55,1.26,s,
H,56,1.26,s,
H,57,1.71,dd,"12.3,6.2"
H,58,1.01,m,
H,59,1.01,m,
H,60,1.01,m,
H,61,1.01,m,
H,62,1.22,dd,"12.2,5.7"
H,63,0.83,s,
H,64,0.83,s,
H,65,0.83,s,
H,66,1.29,ddd,"12.4,7.6,2.4"
H,67,1.29,ddd,"12.4,12.1,6.1"
H,68,1.66,m,
H,69,1.66,m,
H,70,3.32,dd,"9.2,6.4"
H,71,,,
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,77,0.94,s,
H,78,0.73,dd,"11.8,3.3"
H,79,1.46,m,
H,80,1.46,m,
H,81,1.41,ddd,"12.4,6.1,2.3"
H,82,1.41,ddd,"12.9,12.4,8.2"
H,83,1.01,s,
H,84,1.01,s,
H,85,1.01,s,
