ATOM 35
1 C2y C 25.5367 -20.9489
2 C2y C 25.5367 -22.3741
3 N1x N 26.7710 -23.0867
4 C2y C 28.0053 -22.3741
5 C2y C 28.0053 -20.9489
6 C1y C 26.7710 -20.2362
7 C8y C 26.7710 -18.4610
8 C8y C 28.0060 -17.7480
9 C8x C 28.0060 -16.3227
10 C8x C 26.7718 -15.6101
11 C8x C 25.5367 -16.3231
12 C8x C 25.5367 -17.7484
13 O6a O 29.2413 -19.3339
14 C7a C 29.2410 -20.2355
15 O7a O 30.4767 -20.9489
16 C1b C 31.7117 -20.2359
17 C1b C 32.9470 -20.9491
18 C8y C 34.1822 -20.2359
19 C8x C 35.4219 -20.9517
20 C8x C 36.6565 -20.2389
21 C8x C 36.6565 -18.8133
22 C8x C 35.4167 -18.0976
23 N5x N 34.1822 -18.8103
24 C5a C 24.3048 -20.2376
25 N1b N 23.0692 -20.9509
26 O5a O 24.3048 -18.8123
27 C8y C 21.8337 -20.2376
28 C8x C 21.8337 -18.8123
29 C8x C 20.5991 -18.0995
30 C8x C 19.3644 -18.8123
31 C8x C 19.3644 -20.2377
32 C8x C 20.5991 -20.9504
33 C1a C 24.3029 -23.0864
34 C1a C 29.2446 -23.0895
35 X Cl 29.2156 -18.3172
BOND 38
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 6 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 10 11 1
12 11 12 2
13 7 12 1
14 5 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 14 13 2
20 18 19 2
21 19 20 1
22 20 21 2
23 21 22 1
24 22 23 2
25 18 23 1
26 1 24 1
27 24 25 1
28 24 26 2
29 25 27 1
30 27 28 2
31 28 29 1
32 29 30 2
33 30 31 1
34 31 32 2
35 27 32 1
36 2 33 1
37 4 34 1
38 8 35 1
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