 ATOM 12
1 C1d C 25.7202 -16.3111
2 C5a C 26.9380 -15.6080
3 N1b N 28.1559 -16.3111
4 C5a C 29.3738 -15.6080
5 N1a N 30.5917 -16.3111
6 O5a O 29.4018 -14.2017
7 O5a O 26.9407 -14.2017
8 C1b C 24.4848 -15.5976
9 C1a C 23.2784 -16.2939
10 C1b C 25.7200 -17.7097
11 C1a C 24.4851 -18.4228
12 X Br 25.7202 -14.9111
BOND 11
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 4 6 2
6 2 7 2
7 1 8 1
8 8 9 1
9 1 10 1
10 10 11 1
11 1 12 1
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