C,1,22.89,s,
C,2,41.86,s,
C,3,42.83,s,
C,4,71.8,s,
C,5,125.4,s,
C,6,108.3,s,
C,7,143.7,s,
O,8,,,
C,9,139.3,s,
O,10,,,
C,11,166.77,s,
O,12,,,
C,13,135.48,s,
C,14,126.29,s,
C,15,38.16,s,
C,16,43.17,s,
C,17,71.3,s,
O,18,,,
C,19,169.7,s,
O,20,,,
C,21,136.8,s,
C,22,136.7,s,
C,23,25.98,s,
C,24,28.16,s,
C,25,51.21,s,
H,26,1.31,s,
H,27,1.31,s,
H,28,1.31,s,
H,29,2.1,dd,"12.4,9.5"
H,30,2.1,dd,"12.4,6.4"
H,31,5.69,dd,"9.5,6.4"
H,32,6.44,dd,"3.0,1.9"
H,33,7.41,d,3.0
H,34,7.48,d,1.9
H,35,5.54,dd,"5.7,2.7"
H,36,2.22,dd,"15.4,2.7"
H,37,2.22,dd,"15.4,5.7"
H,38,4.13,s,
H,39,4.13,s,
H,40,5.54,dd,"5.3,2.6"
H,41,2.35,m,
H,42,2.35,m,
H,43,1.58,m,
H,44,1.58,m,
H,45,1.45,dd,"12.5,4.5"
