C,1,51.13,s,
O,2,,,
C,3,177.67,s,
O,4,,,
C,5,45.7,s,
C,6,32.2,s,
C,7,32.9,s,
C,8,31.1,s,
C,9,28.34,s,
C,10,28.34,s,
C,11,45.7,s,
C,12,40.8,s,
C,13,142.7,s,
C,14,122.07,s,
C,15,24.0,s,
C,16,47.45,s,
C,17,38.35,s,
C,18,17.05,s,
C,19,46.6,s,
C,20,68.7,s,
O,21,,,
C,22,85.6,s,
O,23,,,
C,24,43.25,s,
C,25,23.65,s,
C,26,65.75,s,
O,27,,,
C,28,51.09,s,
C,29,18.82,s,
C,30,33.41,s,
C,31,39.8,s,
C,32,17.6,s,
C,33,41.11,s,
C,34,26.08,s,
C,35,29.8,s,
C,36,22.5,s,
H,37,3.66,s,
H,38,3.66,s,
H,39,3.66,s,
H,40,1.82,ddd,"13.7,12.4,3.7"
H,41,1.82,ddd,"12.4,4.5,2.6"
H,42,2.25,ddd,"12.4,3.7,2.6"
H,43,2.25,ddd,"13.7,12.4,4.5"
H,44,0.94,s,
H,45,0.94,s,
H,46,0.94,s,
H,47,0.94,s,
H,48,0.94,s,
H,49,0.94,s,
H,50,1.58,dd,"12.4,0.9"
H,51,1.58,dd,"12.4,8.9"
H,52,3.17,dd,"8.9,0.9"
H,53,5.43,dd,"5.1,2.8"
H,54,2.03,ddd,"15.4,8.6,5.1"
H,55,2.03,ddd,"15.4,10.8,2.8"
H,56,1.63,dd,"10.8,8.6"
H,57,1.5,s,
H,58,1.5,s,
H,59,1.5,s,
H,60,2.21,dd,"12.4,9.7"
H,61,2.21,dd,"12.4,5.5"
H,62,3.59,ddd,"9.7,5.5,3.4"
H,63,,,
H,64,4.13,d,3.4
H,65,,,
H,66,1.24,s,
H,67,1.24,s,
H,68,1.24,s,
H,69,4.03,s,
H,70,4.03,s,
H,71,,,
H,72,1.76,dd,"12.0,1.6"
H,73,1.52,m,
H,74,1.52,m,
H,75,1.47,ddd,"12.4,3.5,3.1"
H,76,1.47,ddd,"13.2,12.4,4.5"
H,77,1.08,s,
H,78,1.08,s,
H,79,1.08,s,
H,80,1.27,s,
H,81,1.27,s,
H,82,1.27,s,
H,83,1.65,ddd,"12.4,7.8,2.1"
H,84,1.65,ddd,"12.4,10.0,8.7"
H,85,2.31,ddd,"12.4,10.0,7.8"
H,86,2.31,ddd,"12.4,8.7,2.1"
