C,1,28.34,s,
C,2,30.8,s,
C,3,28.34,s,
C,4,33.93,s,
C,5,32.65,s,
C,6,46.27,s,
C,7,181.68,s,
O,8,,,
O,9,,,
C,10,23.31,s,
C,11,27.77,s,
C,12,44.35,s,
C,13,24.38,s,
C,14,143.92,s,
C,15,122.52,s,
C,16,24.28,s,
C,17,51.21,s,
C,18,37.04,s,
C,19,15.75,s,
C,20,37.88,s,
C,21,26.38,s,
C,22,78.07,s,
O,23,,,
C,24,38.91,s,
C,25,22.7,s,
C,26,22.7,s,
C,27,51.21,s,
C,28,35.12,s,
C,29,75.84,s,
O,30,,,
C,31,47.72,s,
C,32,17.01,s,
C,33,41.8,s,
C,34,46.31,s,
H,35,0.94,s,
H,36,0.94,s,
H,37,0.94,s,
H,38,0.94,s,
H,39,0.94,s,
H,40,0.94,s,
H,41,1.34,ddd,"12.4,6.2,2.7"
H,42,1.34,ddd,"12.5,12.4,5.6"
H,43,1.73,ddd,"12.5,12.4,6.2"
H,44,1.73,ddd,"12.4,5.6,2.7"
H,45,,,
H,46,1.89,ddd,"12.4,12.1,6.6"
H,47,1.89,ddd,"12.4,7.0,3.5"
H,48,1.61,ddd,"12.4,6.6,3.5"
H,49,1.61,ddd,"12.4,12.1,7.0"
H,50,1.26,s,
H,51,1.26,s,
H,52,1.26,s,
H,53,5.43,dd,"5.0,3.0"
H,54,2.0,ddd,"15.4,9.8,3.0"
H,55,2.0,ddd,"15.4,8.9,5.0"
H,56,1.45,dd,"9.8,8.9"
H,57,0.89,s,
H,58,0.89,s,
H,59,0.89,s,
H,60,1.33,ddd,"12.4,6.3,2.0"
H,61,1.33,ddd,"12.5,12.4,5.7"
H,62,1.74,m,
H,63,1.74,m,
H,64,3.34,dd,"10.4,6.4"
H,65,,,
H,66,0.98,s,
H,67,0.98,s,
H,68,0.98,s,
H,69,0.98,s,
H,70,0.98,s,
H,71,0.98,s,
H,72,1.26,dd,"12.6,3.3"
H,73,1.88,ddd,"12.6,12.4,3.9"
H,74,1.88,ddd,"12.4,3.3,2.7"
H,75,4.12,dd,"3.9,2.7"
H,76,,,
H,77,1.25,s,
H,78,1.25,s,
H,79,1.25,s,
H,80,3.25,dd,"13.4,3.9"
H,81,1.58,dd,"12.4,3.9"
H,82,1.58,dd,"13.4,12.4"
