ATOM 25
1 C8x C 20.1414 -20.5659
2 C8x C 20.1414 -21.9679
3 C8x C 21.3584 -22.6688
4 C8x C 22.5683 -21.9679
5 C8y C 22.5683 -20.5659
6 C8x C 21.3584 -19.8650
7 C5a C 23.7736 -19.8650
8 N1b N 24.9844 -20.5659
9 C8y C 26.1951 -19.8650
10 C8x C 27.4075 -20.5631
11 C8x C 28.6183 -19.8621
12 C8y C 28.6166 -18.4631
13 C8x C 27.4041 -17.7650
14 C8x C 26.1934 -18.4660
15 C1c C 29.8273 -17.7621
16 C1b C 31.0381 -18.4559
17 N1b N 32.2488 -17.7550
18 S4a S 33.4595 -18.4490
19 C1c C 34.6703 -17.7480
20 O5a O 23.7665 -18.4631
21 C1a C 29.8243 -16.3602
22 O3c O 32.4612 -19.4402
23 O3c O 34.4507 -19.4402
24 C1a C 35.8853 -18.4474
25 C1a C 34.6686 -16.3461
BOND 26
1 10 11 1
2 11 12 2
3 12 13 1
4 13 14 2
5 14 9 1
6 5 7 1
7 12 15 1
8 1 2 2
9 15 16 1
10 7 8 1
11 16 17 1
12 2 3 1
13 17 18 1
14 8 9 1
15 18 19 1
16 3 4 2
17 7 20 2
18 4 5 1
19 15 21 1
20 5 6 2
21 18 22 2
22 6 1 1
23 18 23 2
24 19 24 1
25 9 10 2
26 19 25 1
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