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,10,23.23,s,
C,11,28.0,s,
C,12,41.54,s,
C,13,26.08,s,
C,14,144.41,s,
C,15,122.29,s,
C,16,23.99,s,
C,17,46.7,s,
C,18,37.6,s,
C,19,13.1,s,
C,20,33.6,s,
C,21,26.2,s,
C,22,71.22,s,
O,23,,,
C,24,47.4,s,
C,25,23.66,s,
C,26,182.48,s,
O,27,,,
O,28,,,
C,29,49.1,s,
C,30,19.7,s,
C,31,32.7,s,
C,32,39.67,s,
C,33,16.87,s,
C,34,41.8,s,
C,35,46.31,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,"12.4,9.5,1.4"
H,43,1.34,ddd,"12.4,11.1,8.2"
H,44,1.73,ddd,"12.4,11.1,1.4"
H,45,1.73,ddd,"12.4,9.5,8.2"
H,46,,,
H,47,1.89,ddd,"12.4,12.1,6.3"
H,48,1.89,ddd,"12.4,5.8,2.9"
H,49,1.65,ddd,"12.4,6.3,2.9"
H,50,1.65,ddd,"12.4,12.1,5.8"
H,51,1.27,s,
H,52,1.27,s,
H,53,1.27,s,
H,54,5.43,dd,"4.5,3.0"
H,55,2.0,ddd,"15.4,10.9,4.5"
H,56,2.0,ddd,"15.4,9.4,3.0"
H,57,1.82,dd,"10.9,9.4"
H,58,1.15,s,
H,59,1.15,s,
H,60,1.15,s,
H,61,1.35,ddd,"12.4,9.7,9.4"
H,62,1.35,ddd,"12.4,8.4,1.6"
H,63,1.96,m,
H,64,1.96,m,
H,65,4.14,dd,"10.1,5.9"
H,66,,,
H,67,1.29,s,
H,68,1.29,s,
H,69,1.29,s,
H,70,,,
H,71,2.45,dd,"10.0,8.5"
H,72,1.83,m,
H,73,1.83,m,
H,74,1.42,ddd,"12.4,11.7,7.0"
H,75,1.42,ddd,"12.4,9.1,1.5"
H,76,1.08,s,
H,77,1.08,s,
H,78,1.08,s,
H,79,3.25,dd,"12.8,2.1"
H,80,1.58,dd,"12.8,12.4"
H,81,1.58,dd,"12.4,2.1"
