ATOM 26
1 C8y C 26.9084 -18.4268
2 C8y C 25.6986 -19.1231
3 C8y C 28.1251 -19.1492
4 C8x C 26.8619 -17.0342
5 C8y C 25.6725 -20.5182
6 C8x C 24.4843 -18.4031
7 C8y C 29.3348 -18.4648
8 N4y N 28.1132 -20.5537
9 C8x C 28.1512 -16.3497
10 C8y C 26.8892 -21.2406
11 C8x C 23.2627 -19.1113
12 C8y C 29.3584 -17.0626
13 C8x C 30.5278 -19.1753
14 C1a C 29.3299 -21.2526
15 C8x C 30.5659 -16.3877
16 C8y C 31.7447 -18.4814
17 C8y C 31.6982 -17.0864
18 O2x O 33.0588 -18.9379
19 O2x O 33.0970 -16.6872
20 C1x C 33.9001 -17.8232
21 C8y C 24.4589 -21.2323
22 C8y C 23.2508 -20.5158
23 O2x O 22.1960 -21.4433
24 C1x C 22.7523 -22.7329
25 O2x O 24.1507 -22.6025
26 O5x O 26.8721 -22.6388
BOND 31
1 2 6 1
2 3 7 1
3 3 8 1
4 4 9 2
5 5 21 1
6 5 10 1
7 6 11 2
8 7 12 2
9 7 13 1
10 8 14 1
11 12 15 1
12 13 16 2
13 15 17 2
14 16 18 1
15 17 19 1
16 18 20 1
17 8 10 1
18 9 12 1
19 11 22 1
20 16 17 1
21 19 20 1
22 1 2 1
23 1 3 2
24 1 4 1
25 2 5 2
26 21 22 2
27 22 23 1
28 23 24 1
29 24 25 1
30 25 21 1
31 10 26 2
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