ATOM 47
1 C8y C 13.6931 -18.8533
2 C1b C 14.8878 -18.1641
3 C5a C 16.0824 -18.8533
4 N1b N 17.2770 -18.1641
5 C1c C 18.4717 -18.8533
6 C5a C 19.6663 -18.1641
7 N1b N 20.8609 -18.8533
8 C1b C 22.0556 -18.1641
9 C1b C 23.2502 -18.8533
10 C1b C 24.4448 -18.1641
11 C1b C 25.6395 -18.8533
12 C1b C 26.8342 -18.1641
13 N1b N 28.0288 -18.8533
14 C1b C 29.2235 -18.1641
15 C1b C 30.3721 -18.8533
16 C1b C 31.5668 -18.1641
17 N1b N 32.7614 -18.8533
18 C1b C 33.9560 -18.1641
19 C1b C 35.1507 -18.8533
20 C1b C 36.3453 -18.1641
21 O5a O 16.0824 -20.2317
22 C1b C 18.4717 -20.2317
23 C5a C 19.6663 -20.9209
24 N1a N 20.8609 -20.2317
25 O5a O 19.6663 -22.2994
26 O5a O 19.6663 -16.7857
27 N1b N 37.5858 -18.8533
28 C5a C 38.7804 -18.1641
29 C1c C 39.9751 -18.8533
30 C1b C 41.1697 -18.1641
31 C1b C 42.3643 -18.8533
32 C1b C 43.5130 -18.1641
33 N1b N 44.7076 -18.8533
34 C2c C 45.9023 -18.1641
35 O5a O 38.7804 -16.7857
36 N1a N 39.9751 -20.2317
37 N1a N 47.1429 -18.8533
38 N2a N 45.9023 -16.7857
39 C8y C 12.4286 -18.2894
40 C8y C 11.5015 -19.3178
41 N4x N 12.1931 -20.5173
42 C8x C 13.5476 -20.2302
43 C8y C 11.9968 -16.9577
44 C8x C 10.6275 -16.6658
45 C8x C 9.7004 -17.6942
46 C8x C 10.1323 -19.0259
47 O1a O 12.9306 -15.9216
BOND 48
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 6 7 1
7 7 8 1
8 8 9 1
9 9 10 1
10 10 11 1
11 11 12 1
12 12 13 1
13 13 14 1
14 14 15 1
15 15 16 1
16 16 17 1
17 17 18 1
18 18 19 1
19 19 20 1
20 3 21 2
21 5 22 1 #Down
22 22 23 1
23 23 24 1
24 23 25 2
25 6 26 2
26 20 27 1
27 27 28 1
28 28 29 1
29 29 30 1
30 30 31 1
31 31 32 1
32 32 33 1
33 33 34 1
34 28 35 2
35 29 36 1 #Down
36 34 37 1
37 34 38 2
38 1 39 1
39 39 40 1
40 40 41 1
41 41 42 1
42 1 42 2
43 39 43 2
44 43 44 1
45 44 45 2
46 45 46 1
47 40 46 2
48 43 47 1
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