ATOM 46
1 N1a N 12.7597 -13.8600
2 C1c C 13.9722 -13.1600
3 C5a C 15.1846 -13.8600
4 N1b N 16.3970 -13.1600
5 C1c C 17.6095 -13.8600
6 C5a C 18.8219 -13.1600
7 N1b N 20.0344 -13.8600
8 C1c C 21.2468 -13.1600
9 C5a C 22.4592 -13.8600
10 N1b N 23.6717 -13.1600
11 C1c C 24.8841 -13.8600
12 C5a C 26.0965 -13.1600
13 N1a N 27.3090 -13.8600
14 O5a O 26.0965 -11.7601
15 C1b C 24.8841 -15.2596
16 C8y C 26.0709 -15.9450
17 C8x C 26.0711 -17.3597
18 C8x C 27.2836 -18.0595
19 C8x C 28.4959 -17.3594
20 C8x C 28.4958 -15.9448
21 C8x C 27.2833 -15.2449
22 O5a O 22.4592 -15.2600
23 C1b C 21.2468 -11.7604
24 O5a O 18.8219 -11.7600
25 C1b C 22.4870 -11.0507
26 C1b C 22.4763 -9.6508
27 C1b C 23.6833 -8.9415
28 N1a N 23.6726 -7.5415
29 C1b C 17.6095 -16.6597
30 C8y C 18.8447 -17.3732
31 C8y C 18.8443 -18.7599
32 C8x C 20.0566 -19.4603
33 C8y C 21.2692 -18.7606
34 C8x C 21.2696 -17.3739
35 C8y C 20.0574 -16.6735
36 O1a O 22.4892 -19.4656
37 C1a C 17.6209 -19.4658
38 C1a C 20.0575 -15.2604
39 O5a O 15.1846 -15.2600
40 C1b C 13.9722 -11.7603
41 C1b C 15.2093 -11.0546
42 C1b C 15.2031 -9.6546
43 N1b N 16.4124 -8.9492
44 C2c C 16.4061 -7.5492
45 N1a N 17.6155 -6.8439
46 N2a N 15.1758 -6.8459
BOND 47
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 12 14 2
14 11 15 1 #Down
15 15 16 1
16 16 17 2
17 17 18 1
18 18 19 2
19 19 20 1
20 20 21 2
21 16 21 1
22 9 22 2
23 8 23 1 #Up
24 6 24 2
25 23 25 1
26 25 26 1
27 26 27 1
28 27 28 1
29 5 29 1 #Down
30 29 30 1
31 30 31 2
32 31 32 1
33 32 33 2
34 33 34 1
35 34 35 2
36 30 35 1
37 33 36 1
38 31 37 1
39 35 38 1
40 3 39 2
41 2 40 1 #Down
42 40 41 1
43 41 42 1
44 42 43 1
45 43 44 1
46 44 45 1
47 44 46 2
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