ATOM 30
1 C8x C 20.7200 -30.8000
2 C8y C 20.7200 -29.4000
3 C8x C 19.5300 -28.7000
4 C8y C 18.2700 -29.4000
5 C8x C 18.2700 -30.8000
6 C8x C 19.5300 -31.5000
7 O2a O 21.9100 -28.7000
8 C8y C 23.1000 -29.4000
9 C8x C 23.1000 -30.8000
10 C8x C 24.3600 -31.5000
11 C8x C 25.5500 -30.8000
12 C8x C 25.5500 -29.4000
13 C8x C 24.3600 -28.7000
14 C1c C 17.0800 -28.7000
15 O7a O 15.8900 -29.4000
16 C7a C 14.7000 -28.7000
17 C1c C 13.5100 -29.4000
18 C8y C 12.3200 -28.7000
19 C3b C 17.0800 -27.3000
20 N3a N 17.0800 -25.9000
21 O6a O 14.7000 -27.3000
22 C1c C 13.5100 -30.8000
23 C1a C 12.3200 -31.5000
24 C1a C 14.7000 -31.5000
25 C8x C 12.3200 -27.3000
26 C8x C 11.0600 -26.6000
27 C8y C 9.8700 -27.3000
28 C8x C 9.8700 -28.7000
29 C8x C 11.0600 -29.4000
30 X Cl 8.6800 -26.6000
BOND 32
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 2 7 1
8 7 8 1
9 8 9 2
10 9 10 1
11 10 11 2
12 11 12 1
13 12 13 2
14 8 13 1
15 4 14 1
16 14 15 1
17 15 16 1
18 16 17 1
19 17 18 1
20 14 19 1 #Down
21 19 20 3
22 16 21 2
23 17 22 1 #Up
24 22 23 1
25 22 24 1
26 18 25 1
27 25 26 2
28 26 27 1
29 27 28 2
30 28 29 1
31 18 29 2
32 27 30 1
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