ATOM 21
1 C1z C 26.6975 -19.3784
2 C1y C 26.6975 -20.7838
3 C8y C 26.6799 -17.9791
4 C1x C 28.0269 -18.9470
5 C2x C 25.4846 -18.6846
6 N1y N 28.0327 -21.2153
7 C1x C 25.4846 -21.4892
8 C8x C 27.8928 -17.2618
9 C8x C 25.4614 -17.2911
10 C1x C 28.8491 -20.0840
11 C2x C 24.2661 -19.3784
12 C1a C 28.7207 -22.4223
13 C5x C 24.2661 -20.7838
14 C8y C 27.8812 -15.8624
15 C8x C 25.4497 -15.8917
16 O5x O 23.0474 -21.4776
17 C8y C 26.6567 -15.1744
18 O2a O 29.0765 -15.1627
19 O2a O 26.6451 -13.7808
20 C1a C 30.2892 -15.8507
21 C1a C 27.8578 -13.0695
BOND 23
1 1 2 1
2 1 3 1 #Down
3 1 4 1
4 1 5 1
5 2 6 1
6 2 7 1
7 3 8 2
8 3 9 1
9 4 10 1
10 5 11 2
11 6 12 1
12 7 13 1
13 8 14 1
14 9 15 2
15 13 16 2
16 14 17 2
17 14 18 1
18 17 19 1
19 18 20 1
20 19 21 1
21 6 10 1
22 11 13 1
23 15 17 1
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