C,1,28.34,s,
C,2,29.4,s,
C,3,28.34,s,
C,4,33.93,s,
C,5,33.5,s,
C,6,46.5,s,
C,7,179.7,s,
O,8,,,
O,9,,,
C,10,23.7,s,
C,11,27.8,s,
C,12,43.0,s,
C,13,26.0,s,
C,14,144.6,s,
C,15,112.6,s,
C,16,131.07,s,
C,17,161.75,s,
C,18,82.7,s,
C,19,40.59,s,
C,20,71.72,s,
O,21,,,
C,22,77.86,s,
O,23,,,
C,24,41.86,s,
C,25,23.79,s,
C,26,72.44,s,
O,27,,,
C,28,45.19,s,
C,29,17.82,s,
C,30,33.06,s,
C,31,24.95,s,
C,32,44.35,s,
C,33,24.38,s,
C,34,41.9,s,
C,35,46.4,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,41,0.94,s,
H,42,1.34,ddd,"12.4,9.2,1.5"
H,43,1.34,ddd,"12.4,11.2,8.2"
H,44,1.73,ddd,"12.4,9.2,8.2"
H,45,1.73,ddd,"12.4,11.2,1.5"
H,46,,,
H,47,1.89,ddd,"12.4,11.2,7.0"
H,48,1.89,ddd,"12.4,7.8,1.7"
H,49,1.61,ddd,"12.4,11.2,7.8"
H,50,1.61,ddd,"12.4,7.0,1.7"
H,51,1.26,s,
H,52,1.26,s,
H,53,1.26,s,
H,54,6.88,s,
H,55,6.88,s,
H,56,2.27,dd,"12.4,5.8"
H,57,2.27,dd,"12.4,8.5"
H,58,4.0,ddd,"8.5,6.0,5.8"
H,59,,,
H,60,4.13,d,6.0
H,61,,,
H,62,1.13,s,
H,63,1.13,s,
H,64,1.13,s,
H,65,4.13,s,
H,66,4.13,s,
H,67,1.13,s,
H,68,1.13,s,
H,69,1.13,s,
H,70,1.72,ddd,"12.4,11.8,6.2"
H,71,1.72,ddd,"12.4,10.5,1.7"
H,72,1.72,ddd,"12.4,10.5,6.2"
H,73,1.72,ddd,"12.4,11.8,1.7"
H,74,1.26,s,
H,75,1.26,s,
H,76,1.26,s,
H,77,3.16,dd,"13.0,3.3"
H,78,1.58,dd,"13.0,12.4"
H,79,1.58,dd,"12.4,3.3"
