ATOM 28
1 C8y C 26.4957 -28.7402
2 C8y C 25.2838 -28.0411
3 C8y C 26.5541 -30.1385
4 O2x O 27.7075 -28.0470
5 C1y C 25.2954 -26.6370
6 C8y C 24.0661 -28.7402
7 C8y C 25.2838 -30.8434
8 C8y C 27.6958 -30.8493
9 C8y C 28.9193 -28.7519
10 N1y N 24.1651 -25.8097
11 C1x C 26.4315 -25.8156
12 C8y C 24.0661 -30.1385
13 O1a O 22.8543 -28.0411
14 O1a O 25.2721 -32.2476
15 C8x C 28.9135 -30.1502
16 O5x O 27.7542 -32.2476
17 C8y C 30.1369 -28.0587
18 C1x C 24.6022 -24.4813
19 C1a C 22.9476 -26.5088
20 C1x C 26.0005 -24.4813
21 O2a O 22.8601 -30.8434
22 C8x C 31.3430 -28.7636
23 C8x C 30.1429 -26.6604
24 C1a C 21.6483 -30.1385
25 C8x C 32.5606 -28.0703
26 C8x C 31.3605 -25.9612
27 C8y C 32.5666 -26.6720
28 O1a O 33.7667 -25.9612
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 8 15 1
15 8 16 2
16 9 17 1
17 10 18 1
18 10 19 1
19 11 20 1
20 12 21 1
21 17 22 2
22 17 23 1
23 21 24 1
24 22 25 1
25 23 26 2
26 25 27 2
27 27 28 1
28 7 12 2
29 9 15 2
30 18 20 1
31 26 27 1
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