ATOM 54
1 C1x C 32.5302 -25.1704
2 C1y C 32.5302 -26.5685
3 C1y C 33.7409 -27.2676
4 C1y C 34.9518 -26.5685
5 C1y C 34.9518 -25.1704
6 O2x O 33.7409 -24.4714
7 O2a O 36.1812 -24.4604
8 C1y C 37.3921 -23.7613
9 C1y C 38.6312 -24.4769
10 C1x C 39.8421 -23.7779
11 C1y C 39.8423 -22.3797
12 C1y C 38.6032 -21.6642
13 C1y C 37.3923 -22.3631
14 N1b N 33.7409 -28.6656
15 C1a C 32.5134 -29.3745
16 N1a N 38.6310 -25.8693
17 O1a O 36.2098 -21.6801
18 N1a N 41.0765 -21.6671
19 O2a O 38.6034 -20.2770
20 C1y C 39.8208 -19.5743
21 O2x O 41.0177 -20.2658
22 C1y C 42.2287 -19.5670
23 C1y C 42.2290 -18.1689
24 C1y C 41.0321 -17.4774
25 C1y C 39.8211 -18.1761
26 C1b C 43.4579 -20.2771
27 N1a N 38.5967 -17.4687
28 O1a O 31.3508 -27.2489
29 O1a O 41.0324 -16.1024
30 O1a O 43.4191 -17.4826
31 O1a O 43.4573 -21.7036
32 N4y N 43.9359 -28.6767
33 C8y C 45.0089 -29.4174
34 C1y C 42.6530 -29.0966
35 C8x C 44.4199 -27.2771
36 C8y C 46.2452 -28.5075
37 N5x N 45.1430 -30.8401
38 O2x O 41.5100 -28.2393
39 C1y C 42.2214 -30.3504
40 N5x N 45.8721 -27.2830
41 C8y C 47.5049 -29.0616
42 C8x C 46.4726 -31.4291
43 C1y C 40.4021 -29.0382
44 C1y C 40.8335 -30.3504
45 O1a O 42.8805 -31.4875
46 N5x N 47.6681 -30.5545
47 N1a N 48.6127 -28.2336
48 C1b C 39.0783 -28.6068
49 O1a O 40.3845 -31.6742
50 O2b O 38.0403 -29.5339
51 P1b P 36.6407 -29.5339
52 O1c O 36.6350 -30.9335
53 O1c O 35.2471 -29.5339
54 O2b O 36.6350 -28.1402
BOND 59
1 1 2 1
2 2 3 1
3 3 4 1
4 4 5 1
5 5 6 1
6 1 6 1
7 5 7 1 #Down
8 8 7 1 #Down
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 12 13 1
14 8 13 1
15 3 14 1 #Up
16 14 15 1
17 9 16 1 #Up
18 13 17 1 #Up
19 11 18 1 #Up
20 12 19 1 #Down
21 20 19 1 #Down
22 20 21 1
23 21 22 1
24 22 23 1
25 23 24 1
26 24 25 1
27 20 25 1
28 22 26 1 #Up
29 25 27 1 #Down
30 2 28 1 #Down
31 24 29 1 #Up
32 23 30 1 #Down
33 26 31 1
34 32 33 1
35 34 32 1 #Up
36 32 35 1
37 33 36 2
38 33 37 1
39 34 38 1
40 34 39 1
41 35 40 2
42 36 41 1
43 37 42 2
44 38 43 1
45 39 44 1
46 39 45 1 #Down
47 41 46 2
48 41 47 1
49 43 48 1 #Up
50 44 49 1 #Down
51 48 50 1
52 50 51 1
53 51 52 1
54 51 53 2
55 51 54 1
56 36 40 1
57 42 46 1
58 43 44 1
59 4 54 1 #Down
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