ATOM 43
1 C8y C 25.8131 -18.7801
2 C8y C 26.9510 -19.6028
3 C2b C 24.6052 -19.4803
4 N4x N 26.2333 -17.4379
5 C8y C 28.0948 -18.7684
6 C1b C 26.9569 -20.9974
7 C2y C 23.3972 -18.7858
8 C8y C 27.6572 -17.4146
9 C1a C 29.4252 -19.1943
10 C2y C 22.2653 -19.6086
11 N2x N 23.0530 -17.4029
12 C2b C 28.3574 -16.1950
13 C2y C 21.1215 -18.7741
14 C1b C 22.2653 -21.0033
15 C2y C 21.5650 -17.4320
16 C2y C 27.6455 -14.9754
17 C1a C 19.7911 -19.2002
18 C1b C 21.0631 -21.7036
19 C1b C 20.8589 -16.2009
20 C2y C 28.0714 -13.6392
21 N1x N 26.2333 -14.9754
22 C6a C 21.0631 -23.0982
23 C1y C 21.5708 -14.9870
24 C1y C 26.9335 -12.8279
25 C2b C 29.3961 -13.2014
26 C5x C 25.8190 -13.6392
27 O6a O 19.8552 -23.7984
28 O6a O 22.2711 -23.7927
29 C2y C 21.1449 -13.6508
30 N1x N 22.9771 -14.9870
31 C1a C 26.9335 -11.4276
32 C1a C 30.4406 -14.1352
33 O5x O 25.0137 -12.6121
34 C2y C 22.2770 -12.8338
35 C1a C 19.8261 -13.2073
36 C5x C 23.4032 -13.6508
37 C2b C 22.2827 -11.4333
38 O5x O 24.1733 -12.5654
39 C2a C 23.4964 -10.7447
40 C1b C 28.1691 -21.6904
41 C6a C 28.1750 -23.0865
42 O6a O 29.3870 -23.7793
43 O6a O 26.9687 -23.7896
BOND 46
1 2 6 1
2 3 7 2
3 4 8 1
4 5 9 1
5 7 10 1
6 7 11 1
7 8 12 1
8 10 13 2
9 10 14 1
10 11 15 2
11 12 16 2
12 13 17 1
13 14 18 1
14 15 19 1
15 16 20 1
16 16 21 1
17 18 22 1
18 19 23 1
19 20 24 1
20 20 25 2
21 21 26 1
22 22 27 1
23 22 28 2
24 23 29 1
25 23 30 1
26 24 31 1 #Down
27 25 32 1
28 26 33 2
29 29 34 2
30 29 35 1
31 30 36 1
32 34 37 1
33 36 38 2
34 37 39 2
35 5 8 2
36 13 15 1
37 24 26 1
38 34 36 1
39 6 40 1
40 1 2 2
41 40 41 1
42 1 3 1
43 41 42 2
44 1 4 1
45 41 43 1
46 2 5 1
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