ATOM 39
1 C8y C 13.5845 -16.5245
2 C8x C 13.5845 -17.9248
3 C8x C 14.7748 -18.6250
4 C8x C 16.0351 -17.9248
5 C8y C 16.0351 -16.5245
6 C8y C 14.7748 -15.8243
7 O1a O 14.7748 -14.4240
8 O1a O 12.3944 -15.8243
9 C5a C 17.2954 -15.8243
10 N1b N 18.4857 -16.5245
11 C1c C 19.6760 -15.8243
12 C1b C 20.9363 -16.5245
13 C1b C 22.1266 -15.8243
14 C1b C 23.3168 -16.5245
15 C1b C 24.5771 -15.8243
16 N1b N 25.7674 -16.5245
17 C5a C 26.9576 -15.8243
18 C8y C 28.2179 -16.5245
19 O5a O 17.2954 -14.4940
20 C1b C 19.6760 -14.4240
21 N1b N 20.9363 -13.7238
22 O5a O 26.9576 -14.4240
23 C8x C 28.2179 -17.9248
24 C8x C 29.4082 -18.6250
25 C8x C 30.5985 -17.9248
26 C8y C 30.5985 -16.5245
27 C8y C 29.4082 -15.8243
28 O1a O 29.4082 -14.4240
29 O1a O 31.8588 -15.8243
30 C5a C 20.9363 -12.3238
31 C8y C 22.1487 -11.6238
32 O5a O 19.7175 -11.6201
33 C8x C 23.3378 -12.3106
34 C8x C 24.5504 -11.6107
35 C8x C 24.5506 -10.2107
36 C8y C 23.3614 -9.5240
37 C8y C 22.1489 -10.2238
38 O1a O 20.9134 -9.5100
39 O1a O 23.3616 -8.1201
BOND 41
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 6 7 1
8 1 8 1
9 5 9 1
10 9 10 1
11 11 10 1 #Down
12 11 12 1
13 12 13 1
14 13 14 1
15 14 15 1
16 15 16 1
17 16 17 1
18 17 18 1
19 9 19 2
20 11 20 1
21 20 21 1
22 17 22 2
23 18 23 2
24 23 24 1
25 24 25 2
26 25 26 1
27 26 27 2
28 18 27 1
29 27 28 1
30 26 29 1
31 21 30 1
32 30 31 1
33 30 32 2
34 31 33 2
35 33 34 1
36 34 35 2
37 35 36 1
38 36 37 2
39 31 37 1
40 37 38 1
41 36 39 1
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