ATOM 29
1 C8x C 22.7538 -20.8017
2 C8x C 22.7538 -19.4003
3 C8y C 23.9450 -18.6996
4 C8y C 25.2062 -19.4003
5 C8y C 25.2062 -20.8017
6 C8x C 23.9450 -21.5024
7 N1b N 26.3974 -21.5024
8 C1b C 26.3974 -18.6996
9 C5a C 26.3974 -22.9038
10 C8y C 27.5886 -23.6045
11 O5a O 25.2062 -23.6045
12 C8x C 28.7798 -22.9038
13 C8x C 30.0411 -23.6045
14 C8x C 30.0411 -25.0059
15 C8x C 28.8499 -25.7066
16 C8x C 27.5886 -25.0059
17 N1c N 27.5886 -19.4003
18 C1b C 28.7798 -18.6996
19 C1a C 27.5886 -20.8017
20 C5a C 29.9710 -19.4003
21 N1y N 31.1622 -18.6996
22 O5a O 29.9710 -20.8017
23 C1x C 31.1622 -17.2981
24 C1x C 32.4235 -16.5974
25 O2x O 33.6147 -17.2981
26 C1x C 33.6147 -18.6996
27 C1x C 32.4235 -19.4003
28 X Cl 23.9276 -17.2901
29 X Cl 32.9841 -22.7637
BOND 30
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 5 7 1
8 4 8 1
9 7 9 1
10 9 10 1
11 9 11 2
12 10 12 2
13 12 13 1
14 13 14 2
15 14 15 1
16 15 16 2
17 10 16 1
18 8 17 1
19 17 18 1
20 17 19 1
21 18 20 1
22 20 21 1
23 20 22 2
24 21 23 1
25 23 24 1
26 24 25 1
27 25 26 1
28 26 27 1
29 21 27 1
30 3 28 1
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