H,1,,,
N,2,,,
C,3,157.38,s,
N,4,,,
N,5,,,
C,6,41.02,s,
C,7,27.13,s,
C,8,25.5,s,
C,9,48.7,s,
N,10,,,
C,11,162.36,s,
O,12,,,
C,13,92.26,s,
O,14,,,
C,15,40.4,s,
C,16,33.89,s,
C,17,111.29,s,
C,18,123.67,s,
N,19,,,
C,20,136.57,s,
C,21,114.65,s,
C,22,114.89,s,
Br,23,,,
C,24,122.15,s,
C,25,120.53,s,
C,26,127.33,s,
C,27,77.48,s,
O,28,,,
C,29,41.32,s,
C,30,111.29,s,
C,31,123.67,s,
N,32,,,
C,33,136.57,s,
C,34,114.65,s,
C,35,114.89,s,
Br,36,,,
C,37,122.15,s,
C,38,120.53,s,
C,39,127.33,s,
C,40,173.25,s,
O,41,,,
N,42,,,
C,43,49.76,s,
C,44,25.6,s,
C,45,27.13,s,
C,46,41.02,s,
N,47,,,
C,48,157.38,s,
N,49,,,
N,50,,,
H,51,,,
H,52,,,
H,53,,,
H,54,,,
H,55,3.16,t,6.4
H,56,3.16,t,6.4
H,57,1.48,tt,"6.6,6.4"
H,58,1.48,tt,"6.6,6.4"
H,59,1.71,tt,"6.6,6.4"
H,60,1.71,tt,"6.6,6.4"
H,61,3.5,t,6.4
H,62,3.5,t,6.4
H,63,,,
H,64,,,
H,65,2.83,t,6.5
H,66,3.01,d,6.5
H,67,3.01,d,6.5
H,68,7.14,d,0.5
H,69,,,
H,70,7.65,dd,"1.4,0.5"
H,71,7.12,dd,"8.1,1.4"
H,72,7.67,dt,"8.1,0.5"
H,73,,,
H,74,3.29,s,
H,75,3.29,s,
H,76,7.12,d,0.5
H,77,,,
H,78,7.65,dd,"1.4,0.5"
H,79,7.12,dd,"7.6,1.4"
H,80,7.67,dt,"7.6,0.5"
H,81,3.34,t,6.7
H,82,3.34,t,6.7
H,83,1.48,tt,"6.7,6.6"
H,84,1.48,tt,"6.7,6.6"
H,85,1.48,tt,"6.6,6.4"
H,86,1.48,tt,"6.6,6.4"
H,87,3.16,t,6.4
H,88,3.16,t,6.4
H,89,,,
H,90,,,
H,91,,,
