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,11,22.21,s,
C,12,33.18,s,
C,13,41.5,s,
C,14,16.09,s,
C,15,51.22,s,
C,16,22.07,s,
C,17,21.5,s,
C,18,51.2,s,
C,19,39.2,s,
C,20,17.2,s,
C,21,40.62,s,
C,22,18.78,s,
C,23,41.2,s,
C,24,33.23,s,
C,25,27.39,s,
C,26,27.39,s,
C,27,61.4,s,
C,28,67.36,s,
O,29,,,
C,30,47.0,s,
C,31,45.8,s,
C,32,17.2,s,
H,33,1.22,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,,,
H,40,2.13,ddd,"10.7,9.7,8.0"
H,41,1.58,m,
H,42,1.58,m,
H,43,1.72,ddd,"12.7,12.4,7.8"
H,44,1.72,ddd,"12.4,6.9,1.4"
H,45,1.04,s,
H,46,1.04,s,
H,47,1.04,s,
H,48,1.61,ddd,"12.6,9.7,4.8"
H,49,1.5,m,
H,50,1.5,m,
H,51,1.42,ddd,"12.4,11.8,2.3"
H,52,1.42,ddd,"12.4,11.9,3.1"
H,53,1.01,s,
H,54,1.01,s,
H,55,1.01,s,
H,56,1.22,dd,"11.8,7.4"
H,57,1.01,m,
H,58,1.01,m,
H,59,1.01,m,
H,60,1.01,m,
H,61,1.47,dd,"11.0,5.9"
H,62,0.97,s,
H,63,0.97,s,
H,64,0.97,s,
H,65,1.44,ddd,"12.4,11.8,6.7"
H,66,1.44,ddd,"12.4,5.2,2.3"
H,67,1.5,m,
H,68,1.5,m,
H,69,1.32,ddd,"12.4,3.7,2.9"
H,70,1.32,ddd,"13.3,12.4,4.3"
H,71,1.06,s,
H,72,1.06,s,
H,73,1.06,s,
H,74,1.06,s,
H,75,1.06,s,
H,76,1.06,s,
H,77,2.26,d,3.9
H,78,4.19,ddd,"7.2,3.9,1.7"
H,79,,,
H,80,2.1,dd,"12.4,7.2"
H,81,2.1,dd,"12.4,1.7"
H,82,1.26,s,
H,83,1.26,s,
H,84,1.26,s,
