ATOM 93
1 O6a O 38.4761 -18.3788
2 C6a C 38.4690 -19.7788
3 C1a C 37.2531 -20.4727
4 O6a O 39.6780 -20.4849
5 C1y C 35.3231 -15.9261
6 N1y N 33.9221 -15.9293
7 C1x C 33.4922 -17.2628
8 C1x C 34.6276 -18.0833
9 C1x C 35.7591 -17.2574
10 C5a C 36.1436 -14.7911
11 N1b N 37.5367 -14.7942
12 O5a O 35.5711 -13.5130
13 C8x C 17.0952 -10.1366
14 C8x C 16.3879 -8.9200
15 C8x C 14.9806 -8.9244
16 C8x C 14.2807 -10.1451
17 C8y C 16.3952 -11.3576
18 C8y C 14.9937 -11.3637
19 C8y C 14.5664 -12.6988
20 C8x C 15.7041 -13.5173
21 N4x N 16.8343 -12.6886
22 C1b C 31.4994 -17.8307
23 C5a C 14.5630 -15.9898
24 N1b N 15.7725 -15.2895
25 C1c C 16.9820 -15.9826
26 C5a C 18.1915 -15.2824
27 N1b N 19.4010 -15.9755
28 C1c C 20.6106 -15.2753
29 C5a C 21.8201 -15.9686
30 N1b N 23.0297 -15.2683
31 C1c C 24.2392 -15.9614
32 C5a C 25.4488 -15.2612
33 N1b N 26.6582 -15.9543
34 C1c C 27.8677 -15.2540
35 C5a C 29.0773 -15.9473
36 N1b N 30.2868 -15.2471
37 C1c C 31.4964 -15.9402
38 C5a C 32.7059 -15.2399
39 O5a O 18.1884 -13.8819
40 C1b C 20.6075 -13.5247
41 C8y C 21.8189 -12.8220
42 C8x C 23.0259 -13.5225
43 C8x C 24.2373 -12.8198
44 C8y C 24.2343 -11.4193
45 C8x C 23.0198 -10.7216
46 C8x C 21.8550 -11.4246
47 O1a O 25.4455 -10.7163
48 O5a O 21.8232 -17.3691
49 C1b C 24.2423 -17.3619
50 O5a O 25.4457 -13.8606
51 C1b C 27.8647 -13.2935
52 C1c C 29.0761 -12.5908
53 C1a C 29.0730 -11.1903
54 C1a C 30.2906 -13.2882
55 O5a O 32.7029 -13.8394
56 O5a O 29.0737 -17.3460
57 C1c C 13.3535 -15.2895
58 N1b N 12.1440 -15.9898
59 C5a C 10.9344 -15.2895
60 C1c C 9.7249 -15.9898
61 N1b N 8.5154 -15.2895
62 C5a C 7.3058 -15.9898
63 O5a O 14.5630 -17.3903
64 C1b C 13.3535 -13.4690
65 O5a O 10.9344 -13.8890
66 C1b C 9.7249 -17.3903
67 C8y C 10.9378 -18.0905
68 N4x N 10.9003 -19.5012
69 C8x C 12.2221 -19.9641
70 N5x N 13.0707 -18.8500
71 C8x C 12.2735 -17.6985
72 O5a O 7.3058 -17.3903
73 C1b C 16.9850 -17.3832
74 O1a O 18.1995 -18.0806
75 O2a O 22.9843 -18.0648
76 C1d C 22.9527 -19.4626
77 C1a C 22.9456 -20.8632
78 C1b C 38.3573 -13.6594
79 C1a C 39.7505 -13.6625
80 C1y C 6.0926 -15.2902
81 N1x N 6.0857 -13.8879
82 C5x C 4.7513 -13.4622
83 C1x C 3.9344 -14.5998
84 C1x C 4.7638 -15.7283
85 O5x O 4.3113 -12.1327
86 C1a C 21.5601 -19.4433
87 C1a C 24.3598 -19.4821
88 C1b C 32.7221 -18.5330
89 C1b C 32.6556 -19.9495
90 N1b N 31.4389 -20.5783
91 C2c C 30.2549 -19.8190
92 N1a N 29.0032 -20.4659
93 N2a N 30.2506 -18.4123
BOND 97
1 2 4 1
2 1 2 2
3 2 3 1
4 41 42 2
5 42 43 1
6 43 44 2
7 44 45 1
8 45 46 2
9 46 41 1
10 10 12 2
11 44 47 1
12 29 48 2
13 31 49 1 #Up
14 23 24 1
15 32 50 2
16 34 51 1 #Up
17 24 25 1
18 51 52 1
19 52 53 1
20 25 26 1
21 52 54 1
22 35 56 2
23 37 22 1 #Down
24 5 6 1
25 38 55 2
26 26 27 1
27 6 7 1
28 23 57 1
29 27 28 1
30 57 58 1
31 7 8 1
32 58 59 1
33 28 29 1
34 59 60 1
35 8 9 1
36 60 61 1
37 29 30 1
38 61 62 1
39 9 5 1
40 23 63 2
41 30 31 1
42 57 64 1 #Up
43 13 14 2
44 59 65 2
45 31 32 1
46 60 66 1 #Down
47 14 15 1
48 66 67 1
49 32 33 1
50 15 16 2
51 33 34 1
52 16 18 1
53 67 68 1
54 68 69 1
55 69 70 2
56 70 71 1
57 71 67 2
58 34 35 1
59 62 72 2
60 17 13 1
61 25 73 1 #Down
62 35 36 1
63 73 74 1
64 64 19 1
65 49 75 1
66 36 37 1
67 75 76 1
68 5 10 1 #Down
69 37 38 1
70 38 6 1
71 76 77 1
72 26 39 2
73 10 11 1
74 28 40 1 #Up
75 11 78 1
76 78 79 1
77 40 41 1
78 80 62 1
79 17 18 2
80 18 19 1
81 19 20 2
82 20 21 1
83 80 81 1
84 81 82 1
85 82 83 1
86 83 84 1
87 80 84 1 #Down
88 21 17 1
89 82 85 2
90 76 86 1
91 76 87 1
92 22 88 1
93 88 89 1
94 89 90 1
95 90 91 1
96 91 92 1
97 91 93 2
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