ATOM 23
1 C8x C 24.0990 -15.2495
2 C8x C 24.0990 -16.6525
3 C8x C 25.3169 -17.3540
4 C8x C 26.5278 -16.6525
5 C8y C 26.5278 -15.2495
6 C8x C 25.3169 -14.5480
7 C1b C 27.7340 -14.5480
8 N1y N 28.9456 -15.2424
9 C1x C 28.9501 -16.6389
10 C1x C 30.1617 -17.3334
11 C1x C 30.1527 -14.5404
12 C8y C 31.3644 -15.2347
13 C8y C 31.3647 -16.6341
14 C8y C 32.6958 -17.0662
15 C8y C 33.5180 -15.9338
16 S2x S 32.6953 -14.8019
17 N1a N 34.9210 -15.9335
18 C7a C 32.6958 -18.4662
19 O6a O 31.4730 -19.1721
20 O7a O 33.9098 -19.1672
21 C1b C 35.0943 -18.4832
22 C1a C 36.2871 -19.1719
23 X Cl 39.2129 -16.5250
BOND 24
1 10 13 1
2 12 11 1
3 11 8 1
4 4 5 1
5 5 6 2
6 6 1 1
7 5 7 1
8 12 13 2
9 13 14 1
10 14 15 2
11 15 16 1
12 16 12 1
13 15 17 1
14 7 8 1
15 1 2 2
16 2 3 1
17 3 4 2
18 8 9 1
19 9 10 1
20 14 18 1
21 18 19 2
22 18 20 1
23 20 21 1
24 21 22 1
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