40 atoms


Coords

1 133.704532 8.353171 523.855838
2 134.502592 9.993882 523.626403
3 133.682479 7.466630 522.244850
4 135.350250 7.573370 521.467248
5 135.738747 9.329192 521.045855
6 134.275111 10.122365 520.256149
7 133.308274 11.205210 522.914528
8 133.817251 11.645082 521.199030
9 135.380629 6.533232 519.900871
10 136.635000 6.923867 522.675726
11 132.839400 8.907830 520.241239
12 134.689317 10.600966 518.483754
13 133.310792 12.752204 523.986196
14 131.575945 10.477134 522.869106
15 131.945550 8.572339 524.483998
16 134.689784 7.359470 525.115722
17 135.572765 5.492214 520.159350
18 136.168221 6.895171 519.239743
19 134.417997 6.610383 519.394903
20 137.188490 6.106709 522.214067
21 136.136690 6.562514 523.575349
22 137.323969 7.726169 522.939750
23 131.972804 9.360521 520.719529
24 133.122262 8.004984 520.779643
25 132.592946 8.651423 519.209628
26 135.749509 10.434408 518.298521
27 134.453995 11.654634 518.327953
28 134.100024 9.992827 517.796122
29 133.679461 12.501636 524.982414
30 132.297861 13.144882 524.062381
31 133.960342 13.503951 523.538063
32 131.034238 10.887689 522.015639
33 131.049287 10.731857 523.788462
34 131.638397 9.395934 522.771691
35 131.761383 9.624565 524.691368
36 131.812932 7.993679 525.398999
37 131.242434 8.220306 523.728857
38 135.686732 7.789514 525.218915
39 134.773059 6.325966 524.781112
40 134.180847 7.389103 526.080194

Types

1 4
2 3
3 3
4 4
5 3
6 4
7 4
8 3
9 1
10 1
11 1
12 1
13 1
14 1
15 1
16 1
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
30 2
31 2
32 2
33 2
34 2
35 2
36 2
37 2
38 2
39 2
40 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
30 0.00000000
31 0.00000000
32 0.00000000
33 0.00000000
34 0.00000000
35 0.00000000
36 0.00000000
37 0.00000000
38 0.00000000
39 0.00000000
40 0.00000000