C,1,26.1,s,
C,2,37.1,s,
C,3,26.1,s,
C,4,46.67,s,
C,5,76.7,s,
O,6,,,
C,7,37.71,s,
C,8,38.82,s,
C,9,28.16,s,
C,10,35.28,s,
C,11,41.86,s,
C,12,62.84,s,
Br,13,,,
C,14,31.5,s,
C,15,35.22,s,
C,16,83.54,s,
C,17,23.46,s,
O,18,,,
C,19,99.23,s,
O,20,,,
C,21,59.16,s,
C,22,35.22,s,
C,23,33.84,s,
C,24,65.7,s,
Br,25,,,
H,26,1.13,s,
H,27,1.13,s,
H,28,1.13,s,
H,29,1.13,s,
H,30,1.13,s,
H,31,1.13,s,
H,32,2.06,s,
H,33,2.06,s,
H,34,,,
H,35,1.96,d,6.2
H,36,1.96,d,6.2
H,37,2.1,m,
H,38,1.58,m,
H,39,1.58,m,
H,40,1.72,ddd,"12.4,4.6,2.8"
H,41,1.72,ddd,"13.8,12.4,3.2"
H,42,4.32,dd,"10.3,4.9"
H,43,2.39,m,
H,44,2.39,m,
H,45,1.67,ddd,"12.4,11.1,2.4"
H,46,1.67,ddd,"12.4,11.2,5.0"
H,47,1.38,s,
H,48,1.38,s,
H,49,1.38,s,
H,50,5.72,s,
H,51,,,
H,52,2.39,d,2.8
H,53,1.9,ddd,"12.4,11.3,8.0"
H,54,1.9,ddd,"12.4,8.5,1.6"
H,55,2.52,m,
H,56,2.52,m,
H,57,4.32,dd,"10.3,2.7"
