ATOM 79
1 C1y C 13.4275 -11.3022
2 C1y C 14.6292 -10.6089
3 C1y C 12.2256 -10.6089
4 O7a O 13.4275 -12.6980
5 C1y C 14.6292 -9.2131
6 N1b N 15.8310 -11.3022
7 C1y C 12.2256 -9.2131
8 O2b O 11.0056 -11.3022
9 C7a C 12.2256 -13.4008
10 O2x O 13.4275 -8.5104
11 O2a O 15.8310 -8.5104
12 C5a C 15.8310 -12.6980
13 C1b C 11.0056 -8.5104
14 P1b P 9.6098 -11.2930
15 C1b C 12.2256 -14.7964
16 O6a O 11.0148 -12.6980
17 C1b C 17.0419 -7.8171
18 C1b C 17.0419 -13.4008
19 O5a O 14.6292 -13.4008
20 O1a O 11.0056 -7.1148
21 O1c O 9.6003 -9.9063
22 O1c O 8.2138 -11.2930
23 O1c O 9.6003 -12.6890
24 C1c C 11.0148 -15.4898
25 C1y C 18.2529 -8.5198
26 C1c C 17.0511 -14.7964
27 C1b C 11.0148 -16.8857
28 O1a O 9.8038 -14.7964
29 C1y C 18.2529 -9.9063
30 O2x O 19.4637 -7.8266
31 C1b C 15.8402 -15.4898
32 O1a O 18.2620 -15.4898
33 C1b C 9.8038 -17.5884
34 C1y C 19.4637 -10.6089
35 O1a O 17.0419 -10.1906
36 C1y C 20.6750 -8.5198
37 C1b C 15.8402 -16.8763
38 C1b C 9.8130 -18.9840
39 C1y C 20.6750 -9.9063
40 O1a O 19.4637 -12.0048
41 O2b O 21.8765 -7.8266
42 C1b C 14.6292 -17.5789
43 C1b C 8.6020 -19.6775
44 N1b N 22.6435 -10.6089
45 P1b P 21.8765 -6.4306
46 C1b C 14.6292 -18.9840
47 C1b C 8.6020 -21.0734
48 C5a C 23.8546 -9.9063
49 O1c O 20.4806 -6.4212
50 O1c O 21.8673 -5.0346
51 O1c O 23.2724 -6.4306
52 C1b C 13.4275 -19.6681
53 C1b C 7.3911 -21.7666
54 C1b C 25.0562 -10.6089
55 O5a O 23.8453 -8.5104
56 C1b C 13.4275 -21.0641
57 C1b C 7.3911 -23.1626
58 C1c C 25.0656 -12.0048
59 C1b C 12.2256 -21.7758
60 C1b C 6.1802 -23.8558
61 C1b C 26.2672 -12.6980
62 O1a O 23.8546 -12.6980
63 C1b C 12.2256 -23.1717
64 C1b C 6.1802 -25.2518
65 C1b C 26.2580 -14.1125
66 C1b C 11.0239 -23.8650
67 C1b C 4.9690 -25.9540
68 C1b C 27.4875 -14.8336
69 C1b C 11.0239 -25.2609
70 C1a C 4.9690 -27.3500
71 C1b C 27.4875 -16.2479
72 C1a C 9.8130 -25.9635
73 C1b C 28.7078 -16.9503
74 C1b C 28.6985 -18.3462
75 C1b C 29.9097 -19.0488
76 C1b C 29.9003 -20.4448
77 C1b C 31.1112 -21.1380
78 C1b C 31.1021 -22.5339
79 C1a C 32.3039 -23.2456
BOND 80
1 1 2 1
2 1 3 1
3 1 4 1 #Up
4 2 5 1
5 2 6 1 #Down
6 3 7 1
7 3 8 1 #Down
8 4 9 1
9 5 10 1
10 5 11 1 #Up
11 6 12 1
12 7 13 1 #Up
13 8 14 1
14 9 15 1
15 9 16 2
16 11 17 1
17 12 18 1
18 12 19 2
19 13 20 1
20 14 21 1
21 14 22 1
22 14 23 2
23 15 24 1
24 25 17 1 #Up
25 18 26 1
26 24 27 1
27 24 28 1 #Up
28 25 29 1
29 25 30 1
30 26 31 1
31 26 32 1 #Down
32 27 33 1
33 29 34 1
34 29 35 1 #Down
35 30 36 1
36 31 37 1
37 33 38 1
38 34 39 1
39 34 40 1 #Up
40 36 41 1 #Down
41 37 42 1
42 38 43 1
43 39 44 1 #Down
44 41 45 1
45 42 46 1
46 43 47 1
47 44 48 1
48 45 49 1
49 45 50 1
50 45 51 2
51 46 52 1
52 47 53 1
53 48 54 1
54 48 55 2
55 52 56 1
56 53 57 1
57 54 58 1
58 56 59 1
59 57 60 1
60 58 61 1
61 58 62 1 #Up
62 59 63 1
63 60 64 1
64 61 65 1
65 63 66 1
66 64 67 1
67 65 68 1
68 66 69 1
69 67 70 1
70 68 71 1
71 69 72 1
72 71 73 1
73 73 74 1
74 74 75 1
75 75 76 1
76 76 77 1
77 77 78 1
78 78 79 1
79 7 10 1
80 36 39 1
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