ATOM 38
1 C1y C 27.7273 -20.0859
2 C5x C 28.8934 -19.4144
3 N1x N 30.0525 -20.0788
4 C1y C 31.2117 -19.4074
5 C1c C 32.3778 -20.0717
6 C1a C 33.5369 -19.4003
7 C8x C 27.2267 -15.1845
8 C8y C 27.2267 -16.5344
9 C8x C 28.3922 -17.2057
10 C8x C 29.5575 -16.5344
11 C8y C 29.5575 -15.1845
12 C8x C 28.3922 -14.5129
13 C2x C 30.7204 -14.5140
14 O2x O 26.0646 -17.2064
15 C1y C 26.0655 -19.1288
16 C2x C 32.3912 -15.4830
17 N1x N 32.3885 -17.4096
18 C5x C 31.2086 -18.0645
19 O5x O 28.8904 -18.0717
20 O5x O 30.0503 -17.3860
21 N1y N 27.7283 -21.4358
22 C8y C 24.8920 -19.8044
23 C8x C 23.7311 -19.1299
24 C8x C 22.5646 -19.8056
25 C8x C 22.5663 -21.1539
26 C8x C 23.7343 -21.8266
27 C8x C 24.9006 -21.1510
28 C1a C 32.3809 -21.4217
29 C1x C 26.6369 -22.2269
30 N1y N 27.0562 -23.5081
31 C1y C 28.3990 -23.5067
32 C5x C 28.8164 -22.2251
33 O5x O 30.0981 -21.8076
34 C1a C 25.9900 -24.5984
35 C1b C 29.5590 -24.1674
36 C1b C 30.7182 -23.4961
37 C1b C 31.8844 -24.1603
38 C1a C 33.0434 -23.4889
BOND 41
1 2 19 2
2 8 9 2
3 18 20 2
4 9 10 1
5 1 21 1 #Up
6 10 11 2
7 15 22 1
8 11 12 1
9 12 7 2
10 1 2 1
11 11 13 1
12 3 4 1
13 22 23 2
14 23 24 1
15 24 25 2
16 25 26 1
17 26 27 2
18 27 22 1
19 8 14 1
20 5 28 1
21 14 15 1
22 4 5 1 #Down
23 13 16 2
24 15 1 1
25 21 29 1
26 29 30 1
27 30 31 1
28 31 32 1
29 32 21 1
30 2 3 1
31 32 33 2
32 16 17 1
33 30 34 1
34 5 6 1
35 31 35 1
36 4 18 1
37 35 36 1
38 18 17 1
39 36 37 1
40 7 8 1
41 37 38 1
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