ATOM 28
1 C8y C 26.7492 -18.4726
2 C8y C 25.5402 -19.1685
3 C8y C 27.9652 -19.1946
4 C8x C 26.7729 -17.0808
5 C8y C 25.5842 -20.5626
6 C8y C 24.3267 -18.4489
7 C8y C 29.1742 -18.5106
8 N5y N 28.0233 -20.5982 #+
9 C8x C 27.9913 -16.3968
10 C8x C 26.7303 -21.2846
11 C8x C 23.1058 -19.1566
12 O2a O 24.3360 -17.0548
13 C8y C 29.1979 -17.1093
14 C8x C 30.3666 -19.2207
15 C1a C 29.1692 -21.2966
16 C1a C 23.1201 -16.3540
17 C8x C 30.4045 -16.4348
18 C8y C 31.6525 -18.5272
19 C8y C 31.6062 -17.1330
20 C8y C 24.3013 -21.2763
21 C8y C 23.0940 -20.5603
22 O2x O 22.0398 -21.4872
23 C1x C 22.5958 -22.7760
24 O2x O 23.9933 -22.6457
25 O2a O 32.8233 -16.4463
26 O2a O 32.7849 -19.2393
27 C1a C 34.0266 -17.1569
28 C1a C 34.0028 -18.5541
BOND 32
1 4 9 2
2 5 20 1
3 5 10 1
4 6 11 2
5 6 12 1
6 7 13 2
7 7 14 1
8 8 15 1
9 12 16 1
10 13 17 1
11 14 18 2
12 17 19 2
13 8 10 2
14 9 13 1
15 11 21 1
16 18 19 1
17 1 2 1
18 1 3 2
19 1 4 1
20 2 5 2
21 20 21 2
22 21 22 1
23 22 23 1
24 23 24 1
25 24 20 1
26 19 25 1
27 2 6 1
28 18 26 1
29 3 7 1
30 25 27 1
31 3 8 1
32 26 28 1
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