ATOM 64
1 C8y C 25.8093 -20.7660
2 C8y C 27.0860 -21.3782
3 C8y C 24.8413 -21.7864
4 C1x C 27.0509 -20.2004
5 C8y C 26.8878 -22.7658
6 C8x C 28.3803 -20.8476
7 N4x N 25.5119 -23.0223
8 S2x S 23.4364 -21.7864
9 C1y C 27.0509 -18.8071
10 C8x C 27.9956 -23.6229
11 C8x C 29.4940 -21.7104
12 C1x C 24.1943 -23.6290
13 O3c O 22.0314 -21.7864
14 N1x N 25.8383 -18.1133
15 C5x C 28.2695 -18.1015
16 C8y C 29.3015 -23.0980
17 C1y C 25.8383 -24.0429
18 C5x C 24.6257 -18.8129
19 N1x N 29.4823 -18.8012
20 O5x O 28.2520 -16.7025
21 O1a O 30.5025 -23.7976
22 C5x C 24.6958 -25.0929
23 N1x N 27.0509 -24.3923
24 C1y C 23.4130 -18.1192
25 O5x O 24.6198 -20.2122
26 C1x C 29.4823 -20.1947
27 N1x N 23.4130 -25.0919
28 O5x O 24.6899 -26.2996
29 C5x C 28.2695 -25.0919
30 N1x N 22.2004 -18.8129
31 C1c C 23.4130 -16.7199
32 C5x C 30.6949 -20.8943
33 C1y C 22.2004 -24.3923
34 C1x C 29.4823 -24.3923
35 O5x O 28.2520 -26.4912
36 C5x C 22.2004 -20.2122
37 C1c C 24.6257 -16.0262
38 C1a C 22.1945 -16.0262
39 N1x N 30.6949 -22.2876
40 O5x O 31.8959 -20.1887
41 C5x C 22.2179 -23.0223
42 C1b C 20.8012 -24.3923
43 N1x N 30.6949 -25.0919
44 C1y C 20.9935 -20.9177
45 O5x O 23.4130 -20.9117
46 C1b C 25.8383 -16.7199
47 O1a O 24.6198 -14.6153
48 C1y C 31.8959 -22.9990
49 N1y N 21.0110 -22.3227
50 O5x O 23.0804 -22.6770
51 C5a C 20.1015 -25.5992
52 C5x C 31.8959 -24.3923
53 C1x C 19.6526 -20.4978
54 O1a O 27.0509 -15.8160
55 C1c C 33.1085 -22.2935
56 C1x C 19.6817 -22.7716
57 N1a N 18.7082 -25.5992
58 O5a O 21.0984 -26.5903
59 O5x O 33.1085 -25.0919
60 C1y C 18.8364 -21.6521
61 C1b C 34.3211 -22.9990
62 C1a C 33.1026 -20.8943
63 O1a O 17.4314 -21.6407
64 C1a C 35.5340 -22.3110
BOND 68
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 5 10 1
10 6 11 2
11 8 12 1 #Up
12 8 13 2
13 9 14 1
14 9 15 1
15 10 16 2
16 12 17 1
17 14 18 1
18 15 19 1
19 15 20 2
20 16 21 1
21 17 22 1
22 17 23 1
23 18 24 1
24 18 25 2
25 19 26 1
26 22 27 1
27 22 28 2
28 23 29 1
29 24 30 1
30 24 31 1
31 26 32 1
32 27 33 1
33 29 34 1
34 29 35 2
35 30 36 1
36 31 37 1
37 31 38 1 #Up
38 32 39 1
39 32 40 2
40 33 41 1
41 33 42 1 #Up
42 34 43 1
43 36 44 1
44 36 45 2
45 37 46 1
46 37 47 1 #Up
47 39 48 1
48 41 49 1
49 41 50 2
50 42 51 1
51 43 52 1
52 44 53 1
53 46 54 1
54 48 55 1
55 49 56 1
56 51 57 1
57 51 58 2
58 52 59 2
59 53 60 1
60 55 61 1
61 55 62 1 #Up
62 60 63 1 #Down
63 61 64 1
64 5 7 1
65 11 16 1
66 44 49 1
67 48 52 1
68 56 60 1
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