ATOM 20
1 C1b C 30.1778 -17.5602
2 C5a C 28.9601 -16.8432
3 N1c N 27.7413 -17.5602
4 O5a O 28.9484 -15.4669
5 C8y C 26.5179 -16.8490
6 C8y C 25.2930 -17.5659
7 C8y C 26.5179 -15.4386
8 C8x C 24.0696 -16.8490
9 C1a C 25.2813 -18.9237
10 C8x C 25.2930 -14.7325
11 C1a C 27.7297 -14.7325
12 C8x C 24.0696 -15.4386
13 C1c C 27.7466 -18.9426
14 C7a C 28.9518 -19.6293
15 O7a O 28.9572 -21.0119
16 O2a O 31.3933 -16.8722
17 C1a C 26.5404 -19.6467
18 O6a O 30.1580 -18.9250
19 C1a C 27.7505 -21.7149
20 C1a C 32.5968 -17.5808
BOND 20
1 10 12 1
2 1 2 1
3 3 13 1
4 13 14 1
5 2 3 1
6 14 15 1
7 2 4 2
8 1 16 1
9 3 5 1
10 5 6 2
11 5 7 1
12 6 8 1
13 6 9 1
14 7 10 2
15 13 17 1
16 7 11 1
17 14 18 2
18 8 12 2
19 15 19 1
20 16 20 1
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