C,1,15.72,s,
C,2,37.01,s,
C,3,32.1,s,
C,4,78.41,s,
O,5,,,
C,6,166.77,s,
O,7,,,
C,8,135.48,s,
C,9,136.7,s,
C,10,25.98,s,
C,11,18.56,s,
C,12,48.76,s,
C,13,42.53,s,
C,14,16.94,s,
C,15,38.86,s,
C,16,21.19,s,
C,17,49.84,s,
C,18,193.6,s,
O,19,,,
C,20,128.9,s,
C,21,108.6,s,
C,22,144.6,s,
O,23,,,
C,24,147.5,s,
H,25,0.87,d,6.6
H,26,0.87,d,6.6
H,27,0.87,d,6.6
H,28,2.4,qdd,"6.6,4.6,2.9"
H,29,1.7,ddd,"12.4,11.2,4.6"
H,30,1.7,ddd,"12.4,3.9,2.9"
H,31,4.77,dd,"11.2,3.9"
H,32,5.54,dd,"5.7,2.6"
H,33,2.35,m,
H,34,2.35,m,
H,35,1.58,m,
H,36,1.58,m,
H,37,2.11,dd,"12.7,2.7"
H,38,1.19,s,
H,39,1.19,s,
H,40,1.19,s,
H,41,0.98,s,
H,42,0.98,s,
H,43,0.98,s,
H,44,2.57,s,
H,45,2.57,s,
H,46,6.38,dd,"2.4,1.9"
H,47,7.39,d,2.4
H,48,7.37,d,1.9
