ATOM 17
1 C8x C 16.8279 -17.1235
2 N5x N 16.8279 -18.5272
3 C8x C 18.0434 -19.2289
4 C8x C 19.2590 -18.5272
5 C8y C 19.2590 -17.1235
6 C8x C 18.0434 -16.4217
7 C2c C 20.4933 -16.4107
8 C2b C 21.7016 -17.1082
9 C8y C 22.8870 -16.4236
10 C8x C 24.0840 -17.1147
11 C8x C 25.2995 -16.4129
12 C8y C 25.2995 -15.0093
13 C8x C 24.1025 -14.3182
14 C8x C 22.8870 -15.0201
15 C1b C 20.4930 -15.0183
16 C1a C 19.2655 -14.3097
17 X Cl 26.5019 -14.3148
BOND 18
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 5 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 13 14 2
15 9 14 1
16 7 15 1
17 15 16 1
18 12 17 1
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