C,1,28.15,s,
C,2,32.6,s,
C,3,28.15,s,
C,4,36.8,s,
C,5,35.5,s,
C,6,48.0,s,
C,7,180.8,s,
O,8,,,
O,9,,,
C,10,32.5,s,
C,11,24.9,s,
C,12,42.0,s,
C,13,19.7,s,
C,14,136.8,s,
C,15,131.6,s,
C,16,40.6,s,
C,17,126.6,s,
C,18,136.39,s,
C,19,49.2,s,
C,20,40.5,s,
C,21,16.1,s,
C,22,33.77,s,
C,23,18.92,s,
C,24,48.76,s,
C,25,38.91,s,
C,26,22.7,s,
C,27,22.7,s,
C,28,75.84,s,
O,29,,,
C,30,44.96,s,
C,31,,,
O,32,,,
C,33,50.95,s,
C,34,18.02,s,
H,35,0.99,s,
H,36,0.99,s,
H,37,0.99,s,
H,38,0.99,s,
H,39,0.99,s,
H,40,0.99,s,
H,41,1.63,ddd,"12.4,11.2,0.8"
H,42,1.63,ddd,"12.4,11.2,6.9"
H,43,1.72,ddd,"12.4,11.2,0.8"
H,44,1.72,ddd,"12.4,11.2,6.9"
H,45,,,
H,46,1.72,ddd,"14.1,12.4,4.2"
H,47,1.72,ddd,"12.4,4.4,3.5"
H,48,1.61,ddd,"12.4,4.4,4.2"
H,49,1.61,ddd,"14.1,12.4,3.5"
H,50,0.99,s,
H,51,0.99,s,
H,52,0.99,s,
H,53,2.43,s,
H,54,2.43,s,
H,55,6.9,d,12.0
H,56,6.16,dd,"12.0,2.6"
H,57,2.83,d,2.6
H,58,1.02,s,
H,59,1.02,s,
H,60,1.02,s,
H,61,1.59,ddd,"12.4,9.0,1.8"
H,62,1.59,ddd,"12.4,10.5,8.1"
H,63,1.69,m,
H,64,1.69,m,
H,65,2.11,dd,"10.9,5.2"
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,72,4.12,dd,"8.4,1.5"
H,73,,,
H,74,2.77,dd,"15.4,1.5"
H,75,2.77,dd,"15.4,8.4"
H,76,1.3,s,
H,77,1.3,s,
H,78,1.3,s,
