ATOM 28
1 C8y C 23.0142 -18.5194
2 C8y C 21.8030 -17.8149
3 C8y C 23.0084 -19.9170
4 O2x O 24.2312 -17.8206
5 C1y C 21.7447 -16.4114
6 C8y C 20.5860 -18.5194
7 C8y C 24.2196 -20.6215
8 C8y C 21.8030 -20.6158
9 C8y C 25.4366 -18.5311
10 C1x C 22.8802 -15.5962
11 N1x N 20.6149 -15.5903
12 C8x C 20.5860 -19.9170
13 O1a O 19.3689 -17.8149
14 C8y C 25.4309 -19.9286
15 O5x O 24.2022 -22.0133
16 O1a O 21.7914 -22.0133
17 C8y C 26.6479 -17.8323
18 C1y C 22.4435 -14.2627
19 C5x C 21.0459 -14.2627
20 O1a O 26.6304 -20.6215
21 C8x C 27.8591 -18.5427
22 C8x C 26.6537 -16.4347
23 C1a C 23.4334 -13.2611
24 O5x O 20.0443 -13.2553
25 C8x C 29.0761 -17.8439
26 C8x C 27.8707 -15.7418
27 C8y C 29.0820 -16.4406
28 O1a O 30.2815 -15.7359
BOND 31
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 5 11 1
11 6 12 1
12 6 13 1
13 7 14 1
14 7 15 2
15 8 16 1
16 9 17 1
17 10 18 1
18 11 19 1
19 14 20 1
20 17 21 2
21 17 22 1
22 18 23 1
23 19 24 2
24 21 25 1
25 22 26 2
26 25 27 2
27 27 28 1
28 8 12 2
29 9 14 2
30 18 19 1
31 26 27 1
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