ATOM 37
1 C1x C 17.5000 -16.2400
2 C1x C 17.5000 -17.6400
3 C1x C 19.9249 -17.6400
4 C1y C 19.9249 -16.2400
5 C5x C 18.7124 -15.5400
6 C1y C 19.9249 -20.4400
7 C1y C 21.1373 -19.7400
8 C1y C 21.1373 -18.3400
9 C1z C 16.2876 -18.3400
10 C1y C 16.2876 -19.7400
11 O7x O 17.5000 -20.4400
12 C7x C 17.5000 -21.8400
13 C1y C 18.7124 -22.5400
14 C5x C 19.9249 -21.8400
15 O6a O 16.2876 -22.5400
16 C1b C 15.0921 -20.4304
17 C1a C 13.9047 -19.7449
18 O1a O 14.9353 -18.7023
19 O5x O 18.7124 -14.1402
20 C1a C 21.1560 -15.5290
21 C1a C 22.3518 -17.6388
22 O2a O 22.3518 -20.4412
23 C1y C 23.5483 -19.7502
24 C1a C 18.7314 -19.7507
25 O5x O 21.1560 -22.5510
26 C1a C 18.7124 -23.9398
27 C1y C 24.7351 -20.4354
28 C1y C 25.9475 -19.7353
29 C1x C 25.9475 -18.3353
30 C1y C 24.7606 -17.6502
31 O2x O 23.5482 -18.3502
32 C1a C 24.7605 -16.2401
33 O1a O 24.7352 -21.8398
34 N1c N 27.1788 -20.4463
35 C1a C 28.3798 -19.7528
36 C1a C 27.1787 -21.8399
37 C1a C 15.9252 -16.9877
BOND 38
1 1 2 1
2 3 4 1
3 4 5 1
4 1 5 1
5 6 7 1
6 7 8 1
7 3 8 1
8 2 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 6 1
15 12 15 2
16 10 16 1
17 16 17 1
18 9 18 1
19 5 19 2
20 4 20 1
21 8 21 1
22 7 22 1
23 22 23 1
24 6 24 1
25 14 25 2
26 13 26 1
27 23 27 1
28 27 28 1
29 28 29 1
30 29 30 1
31 30 31 1
32 23 31 1
33 30 32 1
34 27 33 1
35 28 34 1
36 34 35 1
37 34 36 1
38 9 37 1
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