ATOM 57
1 C1y C 0.5034 -0.3000
2 O2x O -0.0655 0.1138
3 N4y N 0.7828 0.3552
4 C1y C 0.3069 -0.9552
5 C1y C -0.6241 -0.2897
6 C8y C 0.3759 0.9345
7 C8x C 1.4414 0.4655
8 C1y C -0.4034 -0.9552
9 O1a O 0.7448 -1.5414
10 C1b C -1.3207 -0.0655
11 N5x N 0.6483 1.5552
12 O5x O -0.2862 0.8690
13 C8x C 1.7138 1.0862
14 O2b O -0.8345 -1.5517
15 O2b O -1.4759 0.9310
16 C8y C 1.3138 1.6276
17 P1b P -0.8379 -2.2793
18 P1b P -2.1621 0.9276
19 N1a N 1.5793 2.2379
20 O2b O -0.1034 -2.2793
21 O1c O -0.8414 -3.0172
22 O1c O -1.5690 -2.2793
23 O2b O -2.1552 1.6207
24 O1c O -2.1621 0.2414
25 O1c O -2.8483 0.9310
26 C1b C 0.0448 -3.2793
27 C1y C -1.7483 2.1759
28 C1y C 0.7448 -3.5103
29 C1y C -1.9655 2.8345
30 C1y C -1.0379 2.1759
31 O2x O 1.3069 -3.1034
32 C1y C 0.9586 -4.1724
33 O2x O -1.4103 3.2379
34 C1b C -2.6241 3.0414
35 C1y C -0.8379 2.8241
36 O1a O -0.6310 1.6207
37 C1y C 1.8759 -3.5172
38 C1y C 1.6724 -4.1724
39 O1a O 0.5276 -4.7655
40 O1a O -3.1345 2.5793
41 N4y N -0.5621 3.4793
42 N4y N 2.1517 -2.8621
43 O1a O 2.0862 -4.7310
44 C8y C -0.9690 4.0552
45 C8x C 0.1000 3.5897
46 C8y C 1.7448 -2.2828
47 C8x C 2.8103 -2.7517
48 N5x N -0.6931 4.6793
49 O5x O -1.6310 3.9931
50 C8x C 0.3724 4.2069
51 N5x N 2.0172 -1.6621
52 O5x O 1.0793 -2.3517
53 C8x C 3.0828 -2.1345
54 C8y C -0.0310 4.7483
55 C8y C 2.6828 -1.5897
56 N1a N 0.2379 5.3552
57 N1a N 2.9483 -0.9793
BOND 62
1 1 2 1
2 1 3 1 #Up
3 1 4 1
4 2 5 1
5 3 6 1
6 3 7 1
7 4 8 1
8 4 9 1 #Down
9 5 10 1 #Up
10 6 11 1
11 6 12 2
12 7 13 2
13 8 14 1 #Down
14 10 15 1
15 11 16 2
16 14 17 1
17 15 18 1
18 16 19 1
19 17 20 1
20 17 21 1
21 17 22 2
22 18 23 1
23 18 24 1
24 18 25 2
25 20 26 1
26 27 23 1 #Down
27 28 26 1 #Up
28 27 29 1
29 27 30 1
30 28 31 1
31 28 32 1
32 29 33 1
33 29 34 1 #Up
34 30 35 1
35 30 36 1 #Down
36 31 37 1
37 32 38 1
38 32 39 1 #Down
39 34 40 1
40 35 41 1 #Up
41 37 42 1 #Up
42 38 43 1 #Down
43 41 44 1
44 41 45 1
45 42 46 1
46 42 47 1
47 44 48 1
48 44 49 2
49 45 50 2
50 46 51 1
51 46 52 2
52 47 53 2
53 48 54 2
54 51 55 2
55 54 56 1
56 55 57 1
57 5 8 1
58 13 16 1
59 33 35 1
60 37 38 1
61 50 54 1
62 53 55 1
BRACKET 1 -1.7793 0.3276 -1.0379 0.3276
1 0.3103 -2.8621 -0.4276 -2.8621
1 n
ORIGINAL 1 1 2 3 4 5 6 7 8 9 10 11 12 13 14 16 17
1 19 20 21 22
REPEAT 1
| 
