ATOM 20
1 C8y C 26.3132 -15.6044
2 C8x C 26.3132 -14.2050
3 C8x C 25.1004 -13.5053
4 C8x C 23.8874 -14.2050
5 C8x C 23.8874 -15.6044
6 C8x C 25.1004 -16.3042
7 C7a C 27.5260 -16.3042
8 O7a O 28.7389 -15.6044
9 O6a O 27.5260 -17.7036
10 C1c C 29.9518 -16.3042
11 C1b C 31.1646 -15.6044
12 C1a C 29.9518 -17.7036
13 N1b N 32.3775 -16.3042
14 C1y C 33.5903 -15.6044
15 C1x C 34.8031 -16.3042
16 C1x C 36.0161 -15.6044
17 C1x C 36.0161 -14.2050
18 C1x C 34.8031 -13.5053
19 C1x C 33.5903 -14.2050
20 X Cl 38.7216 -15.4645
BOND 20
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 1 7 1
8 7 8 1
9 7 9 2
10 8 10 1
11 10 11 1
12 10 12 1
13 11 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 18 19 1
20 14 19 1
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