ATOM 20
1 C8y C 29.4710 -19.3843
2 C8x C 29.4710 -20.7838
3 C8x C 30.6829 -21.4835
4 C8y C 31.8950 -20.7838
5 C8x C 31.8950 -19.3843
6 C8x C 30.6829 -18.6846
7 X F 33.1256 -21.4945
8 C1d C 28.2590 -18.6846
9 C1b C 27.0470 -19.3843
10 N4y N 25.8350 -18.6846
11 O1a O 27.0471 -17.9849
12 C1b C 29.4710 -17.9849
13 Z Si 29.4711 -16.5854
14 N5x N 25.6888 -17.2925
15 C8x C 24.3196 -17.0014
16 N5x N 23.6197 -18.2137
17 C8x C 24.5563 -19.2539
18 C1a C 30.8273 -15.7432
19 C1a C 28.2599 -15.8861
20 C1a C 30.8947 -17.3561
BOND 21
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 4 7 1
8 1 8 1
9 8 9 1
10 9 10 1
11 8 11 1
12 8 12 1
13 12 13 1
14 10 14 1
15 14 15 2
16 15 16 1
17 16 17 2
18 10 17 1
19 13 18 1
20 13 19 1
21 13 20 1
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