Triclinic periodic calculation

64 atoms
0.0 10.4623 xlo xhi
0.0 9.10902 ylo yhi
0.0 10.6008 zlo zhi
-5.17702 -0.273433 0.71284 xy xz yz
1 atom types
 
Atoms
 
1 1 -0.0430826 0.115296 0.202802
2 1 -0.136623 0.0595937 3.05988
3 1 -0.303173 0.402205 4.89357
4 1 -0.0276834 0.334505 7.92467
5 1 -1.31707 2.22617 -0.102221
6 1 -1.2854 2.14432 2.82217
7 1 -1.38223 2.40391 4.88676
8 1 -1.52216 2.48021 7.77842
9 1 -2.6326 4.53463 0.181318
10 1 -2.52911 4.73367 2.17148
11 1 -2.70272 5.13572 5.29351
12 1 -2.79845 4.92805 7.71147
13 1 -3.84074 6.90959 0.133047
14 1 -4.02284 7.03418 2.36212
15 1 -3.94316 6.99519 4.93003
16 1 -3.82567 7.50166 7.75349
17 1 2.80879 0.0390403 -0.289936
18 1 2.50906 0.149879 2.92328
19 1 2.47609 0.201173 5.15515
20 1 2.39848 0.755178 7.96573
21 1 1.30067 2.26939 -0.0162389
22 1 1.3322 2.23612 2.56102
23 1 1.43269 2.32698 5.33682
24 1 0.997156 2.84236 7.7662
25 1 0.335137 4.35968 -0.417904
26 1 -0.0835215 5.02199 2.22868
27 1 -0.0747447 4.77134 5.08816
28 1 -0.136421 4.86033 7.73109
29 1 -1.12424 6.89488 -0.0331194
30 1 -1.67836 7.07189 2.72226
31 1 -1.39063 6.95309 5.06575
32 1 -1.54387 7.49711 7.4399
33 1 5.1208 -0.138776 0.333694
34 1 5.30155 0.134077 2.4594
35 1 5.27699 0.00484285 4.9212
36 1 4.85928 0.233865 7.63149
37 1 3.97831 2.27292 -0.000362991
38 1 3.94969 2.3684 2.5422
39 1 3.84843 2.64726 5.29769
40 1 3.63978 2.5476 7.93726
41 1 2.87518 4.1926 -0.107875
42 1 2.32498 4.73478 2.67503
43 1 2.54136 4.68928 4.67454
44 1 2.25924 4.7252 7.75096
45 1 1.06839 6.97292 -0.00496059
46 1 1.32109 7.03447 2.67824
47 1 1.24084 7.04082 5.05633
48 1 1.38535 6.77454 7.91628
49 1 8.05661 0.321403 -0.170494
50 1 7.81102 0.0822359 2.86153
51 1 7.82491 0.192494 5.73545
52 1 7.56629 0.435652 7.81187
53 1 6.5856 2.29276 0.0590417
54 1 6.6217 2.25416 3.01817
55 1 6.54816 2.54821 5.14252
56 1 6.36274 2.84257 8.10785
57 1 4.9263 4.65842 0.264935
58 1 5.31998 4.33999 2.89505
59 1 4.93083 4.73588 5.44301
60 1 4.88796 4.45959 7.8083
61 1 3.90175 6.71856 0.0507464
62 1 3.88371 7.02909 2.28992
63 1 3.98695 6.94934 4.69665
64 1 3.91958 7.1469 7.65695
 
Masses
 
1 28.0855