ATOM 27
1 C8y C 19.5672 -16.3516
2 C8y C 19.5672 -14.9484
3 C8x C 20.7600 -14.2468
4 C8x C 22.0228 -14.9484
5 C8y C 22.0228 -16.3516
6 C8x C 20.7600 -17.0532
7 S4a S 18.3745 -17.0532
8 C1a C 17.1818 -16.3516
9 O3c O 18.3745 -18.4564
10 O1a O 18.3492 -14.2517
11 C1c C 23.2322 -17.0632
12 C1b C 24.4447 -16.3763
13 O1a O 23.2207 -18.4564
14 N1b N 25.6677 -17.0963
15 C1c C 26.8797 -16.4104
16 C1b C 28.0818 -17.1184
17 C1a C 26.8916 -15.0188
18 C1b C 29.2818 -16.4394
19 C8y C 30.4591 -17.1326
20 C8x C 30.4469 -18.5265
21 C8x C 31.6560 -19.2386
22 C8y C 32.8773 -18.5477
23 C8x C 32.8894 -17.1538
24 C8x C 31.6803 -16.4416
25 O2a O 34.0919 -19.2632
26 C1a C 35.3270 -18.5649
27 X Cl 33.5992 -14.5976
BOND 27
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 1 7 1
8 7 8 1
9 7 9 2
10 2 10 1
11 5 11 1
12 11 12 1
13 11 13 1
14 12 14 1
15 14 15 1
16 15 16 1
17 15 17 1
18 16 18 1
19 18 19 1
20 19 20 2
21 20 21 1
22 21 22 2
23 22 23 1
24 23 24 2
25 19 24 1
26 22 25 1
27 25 26 1
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