Triclinic periodic calculation

64 atoms
0.0 10.5393 xlo xhi
0.0 9.05087 ylo yhi
0.0 10.5272 zlo zhi
-5.43887 -0.143218 -0.114794 xy xz yz
1 atom types
 
Atoms
 
1 1 0.0494125 -0.132091 -0.111737
2 1 -0.184353 0.00430984 2.18102
3 1 -0.11482 0.380294 5.25782
4 1 -0.244788 0.0140152 7.75205
5 1 -1.34009 2.25547 0.00920874
6 1 -1.26592 1.82964 2.63403
7 1 -1.6022 2.11686 4.86106
8 1 -1.66796 2.19179 8.11251
9 1 -2.4686 4.65495 -0.00398125
10 1 -2.76237 4.7379 2.14805
11 1 -2.48563 4.61278 5.50478
12 1 -2.70397 4.5148 8.08626
13 1 -3.98412 6.86221 -0.0428531
14 1 -3.96331 6.85194 2.77309
15 1 -4.2696 6.9471 5.55519
16 1 -4.05263 6.79882 8.03872
17 1 2.63278 -0.0182738 -0.0925887
18 1 2.86231 -0.232189 2.37567
19 1 2.47369 0.049804 5.46796
20 1 2.47607 0.0805706 8.10722
21 1 1.18343 2.27877 -0.357607
22 1 0.95415 1.97479 2.63913
23 1 0.838658 2.26204 5.11571
24 1 1.16339 2.2787 7.75781
25 1 0.00806354 4.51638 -0.0238729
26 1 0.140016 4.43403 2.84088
27 1 0.0408012 4.36729 5.18892
28 1 -0.252097 4.53274 7.85505
29 1 -1.3368 6.84839 0.00618535
30 1 -1.36517 6.60697 2.65842
31 1 -1.62439 6.56981 5.42544
32 1 -1.42765 6.93185 7.96007
33 1 5.27133 -0.0417942 0.548974
34 1 5.19823 -0.120697 2.85717
35 1 5.16191 0.00847631 5.30183
36 1 5.13479 -0.0212469 8.31225
37 1 3.69224 2.55131 0.051838
38 1 4.03576 2.12846 2.49134
39 1 3.86904 2.26035 5.23367
40 1 3.71411 2.63676 8.09455
41 1 2.55809 4.50055 0.36649
42 1 2.65311 4.49618 2.73582
43 1 2.66157 4.48586 5.40926
44 1 2.52374 4.61279 7.85315
45 1 1.03181 6.80245 -0.224966
46 1 1.09542 6.79948 2.63897
47 1 1.26768 6.90023 5.34121
48 1 1.19814 6.81094 7.63642
49 1 7.89469 -0.0278934 0.337221
50 1 7.90211 0.0217282 2.65444
51 1 7.96695 0.205962 5.37915
52 1 7.72314 -2.68416e-05 7.90902
53 1 6.65304 2.20705 0.62969
54 1 6.29274 2.1576 3.08819
55 1 6.49406 2.29964 5.35531
56 1 6.70652 2.22379 8.00048
57 1 5.25236 4.63023 0.1322
58 1 5.22305 4.62625 2.83966
59 1 5.1632 4.60289 5.34535
60 1 5.21651 4.83651 7.70287
61 1 3.80398 6.65708 0.438012
62 1 3.65432 7.1927 2.95946
63 1 3.66801 6.95499 5.4583
64 1 3.73246 6.78356 8.0622
 
Masses
 
1 28.0855