ATOM 66
1 C8y C 12.2500 -15.6100
2 C8x C 12.2500 -17.0100
3 C8y C 13.4624 -17.7100
4 C8x C 14.6749 -17.0100
5 C8y C 14.6749 -15.6100
6 C8y C 13.4624 -14.9100
7 N1b N 11.0376 -14.9100
8 C5a C 9.8251 -15.6100
9 C1b C 9.8251 -17.0100
10 C1b C 11.0376 -17.7100
11 C1b C 11.0376 -19.1100
12 C1b C 12.2500 -19.8100
13 C1d C 13.4624 -19.1100
14 N1b N 12.2500 -21.2100
15 O5a O 8.5940 -14.8990
16 C2c C 13.4624 -21.9100
17 N1a N 14.6579 -21.2196
18 N2a N 13.4625 -23.3098
19 O2a O 13.4624 -13.5102
20 C1y C 12.2332 -12.8004
21 C1x C 12.0883 -11.4194
22 C1x C 10.7301 -11.1304
23 N1x N 10.0356 -12.3328
24 C1x C 10.9645 -13.3649
25 N1b N 15.9060 -14.8990
26 C5a C 17.1112 -15.5947
27 C8y C 18.2935 -14.9119
28 O5a O 17.1116 -17.0096
29 C8x C 19.4875 -15.6012
30 C8y C 20.6999 -14.9012
31 N5x N 20.6999 -13.5012
32 C8x C 19.5059 -12.8118
33 N5x N 18.2935 -13.5119
34 C5a C 21.9312 -15.6121
35 N1b N 23.1285 -14.9207
36 O5a O 21.9312 -17.0098
37 C8y C 24.3149 -15.6056
38 C8x C 24.3150 -17.0098
39 C8y C 25.5275 -17.7097
40 C8x C 26.7399 -17.0096
41 C8y C 26.7398 -15.6055
42 C8y C 25.5273 -14.9056
43 C1b C 27.9524 -17.7095
44 C1b C 29.1648 -17.0095
45 C5a C 29.1647 -15.6053
46 N1b N 27.9522 -14.9054
47 C1d C 25.5276 -19.1097
48 C1b C 26.7401 -19.8096
49 C1b C 27.9525 -19.1095
50 O5a O 30.3938 -14.8953
51 O2a O 25.5273 -13.5102
52 C1y C 26.7568 -12.8003
53 C1x C 28.0253 -13.3651
54 N1x N 28.9544 -12.3332
55 C1x C 28.2602 -11.1306
56 C1x C 26.9019 -11.4193
57 N1b N 26.7402 -21.2100
58 C2c C 25.5277 -21.9102
59 N1a N 24.3320 -21.2198
60 N2a N 25.5277 -23.3098
61 X F 13.4679 -20.5704
62 X F 14.6580 -19.1197
63 X F 12.2333 -19.1002
64 X F 25.5220 -20.2203
65 X F 24.4721 -19.1195
66 X F 26.5465 -19.0999
BOND 70
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
6 1 6 1
7 1 7 1
8 7 8 1
9 8 9 1
10 9 10 1
11 10 11 1
12 11 12 1
13 13 3 1
14 12 14 1
15 8 15 2
16 14 16 1
17 16 17 1
18 16 18 2
19 6 19 1
20 20 19 1 #Up
21 20 21 1
22 21 22 1
23 22 23 1
24 23 24 1
25 20 24 1
26 5 25 1
27 25 26 1
28 26 27 1
29 26 28 2
30 27 29 2
31 29 30 1
32 30 31 2
33 31 32 1
34 32 33 2
35 27 33 1
36 30 34 1
37 34 35 1
38 34 36 2
39 35 37 1
40 37 38 2
41 38 39 1
42 39 40 2
43 40 41 1
44 41 42 2
45 37 42 1
46 43 44 1
47 44 45 1
48 45 46 1
49 41 46 1
50 39 47 1
51 48 49 1
52 43 49 1
53 45 50 2
54 42 51 1
55 52 51 1 #Down
56 52 53 1
57 53 54 1
58 54 55 1
59 55 56 1
60 52 56 1
61 48 57 1
62 57 58 1
63 58 59 1
64 58 60 2
65 13 61 1
66 13 62 1
67 13 63 1
68 47 64 1
69 47 65 1
70 47 66 1
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