ATOM 22
1 C1z C 25.2437 -19.0162
2 C8y C 23.9072 -18.5782
3 O2x O 26.0785 -17.8837
4 C8y C 23.9129 -17.1715
5 C8x C 22.7046 -19.2787
6 C1x C 25.2554 -16.7395
7 C8x C 22.7046 -16.4711
8 C8x C 21.4846 -18.5725
9 C8y C 21.4846 -17.1715
10 C3b C 20.2705 -16.4711
11 N3a N 19.0567 -15.7704
12 C8y C 25.2437 -20.4178
13 C8x C 24.0315 -21.1177
14 C8x C 24.0315 -22.5193
15 C8y C 25.2453 -23.2202
16 C8x C 26.4576 -22.5203
17 C8x C 26.4576 -21.1187
18 X F 25.2450 -24.5952
19 C1b C 26.6454 -19.0162
20 C1b C 27.3308 -20.2033
21 C1b C 28.7337 -20.2033
22 N1a N 29.4246 -21.3997
BOND 24
1 1 2 1
2 1 3 1
3 2 4 2
4 2 5 1
5 3 6 1
6 4 7 1
7 5 8 2
8 7 9 2
9 9 10 1
10 4 6 1
11 8 9 1
12 10 11 3
13 1 12 1
14 12 13 2
15 13 14 1
16 14 15 2
17 15 16 1
18 16 17 2
19 12 17 1
20 15 18 1
21 1 19 1
22 19 20 1
23 20 21 1
24 21 22 1
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