ATOM 29
1 C8y C 20.0610 -17.7222
2 C8y C 20.0553 -19.1263
3 C8y C 21.2837 -17.0319
4 C8x C 18.8560 -17.0262
5 C8y C 21.2662 -19.8342
6 C8x C 18.8560 -19.8283
7 N5x N 22.4889 -17.7222
8 C1b C 21.2720 -15.6339
9 C8x C 17.6391 -17.7222
10 N4y N 22.4772 -19.1263
11 O5x O 21.2603 -21.2265
12 C8x C 17.6391 -19.1263
13 C6a C 22.4772 -14.9261
14 C1b C 23.6881 -19.8342
15 O6a O 23.6939 -15.6279
16 O6a O 22.4829 -13.5278
17 C8y C 24.9048 -19.1322
18 N5x N 25.0570 -17.7399
19 S2x S 26.1860 -19.7054
20 C8y C 26.4200 -17.4474
21 C8y C 27.1220 -18.6641
22 C8x C 27.1279 -16.2305
23 C8x C 28.5200 -18.6641
24 C8y C 28.5260 -16.2365
25 C8x C 29.2163 -17.4474
26 C1d C 29.5145 -15.2420
27 X F 30.5045 -14.2520
28 X F 28.5450 -14.2752
29 X F 30.5277 -16.2522
BOND 32
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 3 8 1
8 4 9 2
9 5 10 1
10 5 11 2
11 6 12 2
12 8 13 1
13 10 14 1
14 13 15 1
15 13 16 2
16 14 17 1
17 17 18 2
18 17 19 1
19 18 20 1
20 19 21 1
21 20 22 1
22 21 23 1
23 22 24 2
24 23 25 2
25 24 26 1
26 7 10 1
27 9 12 1
28 20 21 2
29 24 25 1
30 26 27 1
31 26 28 1
32 26 29 1
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