ATOM 17
1 C8y C 26.2057 -19.8817
2 C5a C 27.3955 -20.6120
3 C8y C 26.1706 -18.4820
4 C8x C 24.9630 -20.5537
5 N1b N 28.6195 -19.9457
6 O5a O 27.3606 -22.0117
7 C8y C 25.0386 -17.7543
8 O1a O 27.4713 -17.8183
9 C8x C 23.7797 -19.8235
10 C8y C 29.8155 -20.6761
11 C8x C 23.8147 -18.4180
12 C8x C 31.0290 -19.9807
13 C8x C 29.8155 -22.0816
14 C8x C 32.2423 -20.6819
15 C8x C 31.0290 -22.7744
16 C8x C 32.2423 -22.0759
17 X Cl 25.0737 -16.3477
BOND 18
1 1 4 1
2 2 5 1
3 2 6 2
4 3 7 1
5 3 8 1
6 4 9 2
7 5 10 1
8 7 11 2
9 10 12 2
10 10 13 1
11 12 14 1
12 13 15 2
13 14 16 2
14 9 11 1
15 15 16 1
16 7 17 1
17 1 2 1
18 1 3 2
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