C,1,14.17,s,
C,2,60.17,s,
O,3,,,
C,4,173.15,s,
O,5,,,
C,6,33.87,s,
C,7,23.6,s,
C,8,18.6,s,
C,9,75.7,s,
C,10,66.4,s,
C,11,65.61,s,
C,12,78.11,s,
C,13,18.9,s,
C,14,28.3,s,
C,15,28.66,s,
C,16,28.66,s,
C,17,28.26,s,
C,18,18.9,s,
C,19,98.85,s,
C,20,82.4,s,
C,21,127.06,s,
C,22,111.32,s,
Br,23,,,
H,24,1.23,t,6.7
H,25,1.23,t,6.7
H,26,1.23,t,6.7
H,27,4.11,q,6.7
H,28,4.11,q,6.7
H,29,2.34,t,6.7
H,30,2.34,t,6.7
H,31,1.76,tt,"6.8,6.7"
H,32,1.76,tt,"6.8,6.7"
H,33,2.34,t,6.8
H,34,2.34,t,6.8
H,35,2.3,t,6.8
H,36,2.3,t,6.8
H,37,1.23,tt,"6.8,6.6"
H,38,1.23,tt,"6.8,6.6"
H,39,1.34,m,6.6
H,40,1.34,m,6.6
H,41,1.34,m,6.6
H,42,1.34,m,6.6
H,43,1.37,tt,"6.8,6.6"
H,44,1.37,tt,"6.8,6.6"
H,45,2.21,t,6.8
H,46,2.21,t,6.8
H,47,6.44,d,14.0
H,48,6.29,d,14.0
