ATOM 21
1 C8x C 24.2537 -18.0153
2 C8x C 24.2537 -19.4167
3 C8x C 25.4712 -20.1139
4 C8x C 25.4712 -17.3113
5 C8y C 26.6745 -18.0153
6 C8y C 26.6662 -19.4127
7 N5x N 27.9931 -19.8502
8 C8y C 28.8237 -18.7231
9 N4y N 28.0063 -17.5864
10 N1b N 30.2251 -18.6612
11 C5a C 28.4519 -16.2560
12 C7a C 30.9152 -19.9498
13 O7a O 32.3165 -19.9580
14 O6a O 30.2109 -21.1603
15 C1a C 33.0277 -18.7475
16 N1b N 29.8246 -15.9741
17 C1b C 30.2631 -14.6435
18 C1b C 31.6358 -14.3618
19 C1b C 32.0744 -13.0312
20 O5a O 27.5182 -15.2142
21 C1a C 33.4470 -12.7493
BOND 22
1 8 10 1
2 9 11 1
3 1 2 1
4 10 12 1
5 2 3 2
6 12 13 1
7 3 6 1
8 12 14 2
9 5 4 1
10 13 15 1
11 5 6 2
12 11 16 1
13 6 7 1
14 16 17 1
15 7 8 2
16 17 18 1
17 8 9 1
18 18 19 1
19 9 5 1
20 11 20 2
21 4 1 2
22 19 21 1
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