C,1,25.83,s,
C,2,76.95,s,
C,3,25.83,s,
O,4,,,
C,5,83.52,s,
C,6,25.35,s,
C,7,35.0,s,
C,8,74.04,s,
C,9,24.4,s,
O,10,,,
C,11,83.52,s,
C,12,30.57,s,
C,13,30.57,s,
C,14,83.52,s,
O,15,,,
C,16,80.53,s,
C,17,23.64,s,
C,18,35.22,s,
C,19,33.84,s,
C,20,67.9,s,
Br,21,,,
C,22,76.95,s,
C,23,25.83,s,
C,24,25.83,s,
O,25,,,
C,26,83.52,s,
C,27,25.35,s,
C,28,32.2,s,
C,29,80.53,s,
C,30,23.64,s,
O,31,,,
C,32,74.04,s,
C,33,24.4,s,
O,34,,,
C,35,35.22,s,
C,36,27.8,s,
C,37,67.9,s,
Br,38,,,
H,39,1.75,s,
H,40,1.75,s,
H,41,1.75,s,
H,42,1.75,s,
H,43,1.75,s,
H,44,1.75,s,
H,45,4.54,t,5.8
H,46,2.02,td,"6.8,5.8"
H,47,2.02,td,"6.8,5.8"
H,48,1.98,t,6.8
H,49,1.98,t,6.8
H,50,1.16,s,
H,51,1.16,s,
H,52,1.16,s,
H,53,,,
H,54,4.54,dd,"11.2,2.2"
H,55,1.95,m,
H,56,1.95,m,
H,57,1.8,m,
H,58,1.8,m,
H,59,4.54,dd,"9.5,8.0"
H,60,1.46,s,
H,61,1.46,s,
H,62,1.46,s,
H,63,1.9,ddd,"12.4,10.8,1.5"
H,64,1.9,dd,"12.4,7.7"
H,65,2.52,ddd,"12.4,11.6,10.8"
H,66,2.52,m,
H,67,4.01,dd,"11.6,2.4"
H,68,1.75,s,
H,69,1.75,s,
H,70,1.75,s,
H,71,1.75,s,
H,72,1.75,s,
H,73,1.75,s,
H,74,4.54,dd,"5.7,1.5"
H,75,2.02,m,
H,76,2.02,m,
H,77,1.9,ddd,"13.6,12.4,3.5"
H,78,1.9,ddd,"12.4,6.2,2.5"
H,79,1.46,s,
H,80,1.46,s,
H,81,1.46,s,
H,82,1.16,s,
H,83,1.16,s,
H,84,1.16,s,
H,85,,,
H,86,1.9,ddd,"12.4,7.5,0.3"
H,87,1.9,ddd,"12.4,8.4,1.4"
H,88,2.02,m,
H,89,2.02,m,
H,90,4.01,dd,"12.2,3.5"
