C,1,14.03,s,
C,2,22.54,s,
C,3,31.69,s,
C,4,24.95,s,
C,5,36.1,s,
C,6,75.98,s,
O,7,,,
C,8,56.7,s,
C,9,114.77,s,
C,10,162.45,s,
O,11,,,
C,12,109.0,s,
C,13,133.2,s,
C,14,108.68,s,
C,15,161.1,s,
O,16,,,
C,17,188.79,s,
O,18,,,
C,19,116.46,s,
C,20,134.56,s,
C,21,111.52,s,
C,22,156.42,s,
O,23,,,
C,24,56.43,s,
C,25,100.37,s,
Br,26,,,
C,27,153.88,s,
O,28,,,
C,29,181.27,s,
O,30,,,
H,31,0.88,t,7.0
H,32,0.88,t,7.0
H,33,0.88,t,7.0
H,34,1.34,qt,"7.0,6.5"
H,35,1.34,qt,"7.0,6.5"
H,36,1.33,tt,"6.6,6.5"
H,37,1.33,tt,"6.6,6.5"
H,38,1.37,m,6.6
H,39,1.37,m,6.6
H,40,1.74,td,"6.6,5.8"
H,41,1.74,td,"6.6,5.8"
H,42,5.64,t,5.8
H,43,3.48,s,
H,44,3.48,s,
H,45,3.48,s,
H,46,,,
H,47,7.09,s,
H,48,,,
H,49,6.94,s,
H,50,3.91,s,
H,51,3.91,s,
H,52,3.91,s,
H,53,,,
