ATOM 28
1 C8x C 26.6700 -20.6500
2 C8y C 26.6700 -22.0500
3 C8x C 27.8600 -22.7500
4 C8x C 29.1200 -22.0500
5 C8y C 29.1200 -20.6500
6 C8x C 27.8600 -19.9500
7 C8x C 31.5000 -22.0500
8 C8y C 31.5000 -20.6500
9 C1c C 30.3100 -19.9500
10 C8x C 32.7600 -22.7500
11 C8x C 33.9500 -22.0500
12 C8x C 33.9500 -20.6500
13 C8x C 32.7600 -19.9500
14 N1y N 30.3100 -18.5500
15 C1x C 31.5000 -17.8500
16 C1x C 31.5000 -16.4500
17 N1y N 30.3100 -15.7500
18 C1x C 29.1200 -16.4500
19 C1x C 29.1200 -17.8500
20 C1b C 30.3100 -14.3500
21 C8y C 31.5000 -13.6500
22 C8x C 32.6900 -14.3500
23 C8y C 33.9500 -13.6500
24 C8x C 33.9500 -12.2500
25 C8x C 32.7600 -11.5500
26 C8x C 31.5000 -12.2500
27 C1a C 35.1400 -14.3500
28 X Cl 25.4800 -22.7500
BOND 31
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 7 8 1
8 8 9 1
9 5 9 1
10 7 10 2
11 10 11 1
12 11 12 2
13 12 13 1
14 8 13 2
15 9 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 18 19 1
21 14 19 1
22 17 20 1
23 20 21 1
24 21 22 2
25 22 23 1
26 23 24 2
27 24 25 1
28 25 26 2
29 21 26 1
30 23 27 1
31 2 28 1
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