29 atoms


Coords

1 127.455554 19.201855 318.117085
2 127.830600 17.385651 318.273504
3 128.190681 16.918061 320.018552
4 129.732407 17.768799 320.549696
5 129.420900 19.569961 320.774746
6 128.304082 20.251767 319.431388
7 130.279810 17.046449 322.192907
8 131.109332 17.524108 319.290749
9 126.319408 16.420421 317.701911
10 129.286037 16.958194 317.164973
11 128.031719 22.106666 319.374029
12 126.398132 19.321596 318.241932
13 127.393711 17.356082 320.611277
14 128.846144 19.649492 321.695344
15 131.070104 17.666133 322.616478
16 130.653595 16.035067 322.038402
17 129.432238 17.020595 322.877237
18 130.977086 18.220528 318.464981
19 131.084508 16.502810 318.915602
20 132.073439 17.711167 319.770699
21 125.437583 17.060507 317.758591
22 126.178360 15.551461 318.345371
23 126.464067 16.092043 316.673785
24 128.954137 16.937940 316.125825
25 129.678759 15.980573 317.439270
26 130.064908 17.709961 317.280828
27 128.811218 22.605773 319.949780
28 127.057246 22.345268 319.797096
29 128.071915 22.445445 318.338766

Types

1 3
2 5
3 3
4 5
5 3
6 5
7 1
8 1
9 1
10 1
11 1
12 2
13 2
14 2
15 2
16 2
17 2
18 2
19 2
20 2
21 2
22 2
23 2
24 2
25 2
26 2
27 2
28 2
29 2

Charges

1 0.00000000
2 0.00000000
3 0.00000000
4 0.00000000
5 0.00000000
6 0.00000000
7 0.00000000
8 0.00000000
9 0.00000000
10 0.00000000
11 0.00000000
12 0.00000000
13 0.00000000
14 0.00000000
15 0.00000000
16 0.00000000
17 0.00000000
18 0.00000000
19 0.00000000
20 0.00000000
21 0.00000000
22 0.00000000
23 0.00000000
24 0.00000000
25 0.00000000
26 0.00000000
27 0.00000000
28 0.00000000
29 0.00000000