Triclinic periodic calculation

64 atoms
0.0 10.7042234 xlo xhi
0.0 10.7042234 ylo yhi
0.0 10.7042234 zlo zhi
0.0 0.0 0.0 xy xz yz
1 atom types
 
Atoms
 
1 1 2.4010384 2.8009794 1.0593894
2 1 1.5148004 5.000337400000001 1.0481604000000002
3 1 4.3778824 3.8594174 0.3278711
4 1 1.7279894000000002 2.4894494 4.4628424
5 1 0.1297629 1.6301264 2.9731554000000004
6 1 3.5636974 2.1610804000000003 2.9739464
7 1 1.3083454000000003 4.720129400000001 4.1867494
8 1 5.1383084000000006 4.743702400000001 3.917766400000001
9 1 5.2483464 0.8931471000000002 5.364220400000001
10 1 4.844392399999999 0.3202786 7.655912399999999
11 1 0.8672969 3.8142994000000003 7.316158400000001
12 1 2.8975314 2.7494954 6.480489400000001
13 1 3.387796400000001 4.885681400000001 5.6775394
14 1 5.254379400000001 3.2776804000000004 5.7834184
15 1 4.2548854 5.243659400000001 8.024864400000002
16 1 0.3230521 1.6845124 8.1994764
17 1 4.263597400000001 0.2325818 9.9843334
18 1 3.1233014 2.2667054 9.6237154
19 1 0.6931568 4.5058604 9.611370400000002
20 1 5.1462764000000005 3.2161264000000003 8.9478264
21 1 0.5883898000000002 7.137859400000001 0.7067927
22 1 4.6948864 7.720458400000001 1.4185134
23 1 2.4492514 8.6382574 1.1453194
24 1 5.1758904 9.803473400000001 2.3304484
25 1 2.9254964 10.6511934 2.4212914000000003
26 1 0.8270548000000001 7.8606024 3.7818684
27 1 2.9680814000000004 7.1281044 2.9567874
28 1 1.0465544 10.186703400000003 3.8462384000000003
29 1 4.167609400000001 8.0393784 4.7857004
30 1 3.2708344 10.289263400000001 4.8344344
31 1 0.6308565 7.2406144 6.0183164
32 1 2.8136554000000005 7.785685400000001 6.7398864000000005
33 1 0.3920157000000001 10.442073400000002 6.9549844
34 1 2.7132714000000004 10.0432634 7.149649399999999
35 1 0.4276244 6.797485400000001 9.1407944
36 1 2.7807554 6.9099974 8.910041400000003
37 1 4.0120494 8.5713504 10.0403334
38 1 5.5393334 2.3566544000000005 1.6628424
39 1 6.2066264 0.36334110000000003 0.6463288
40 1 8.1193594 0.252634 2.0872004000000004
41 1 8.359641400000001 5.1773214 2.4593584
42 1 10.4517034 3.9937184000000006 2.3369434000000004
43 1 9.5660494 3.5591803999999994 0.035032999999999995
44 1 7.4907034 0.1522587 5.3288214
45 1 8.608798400000003 1.7230944000000001 3.8951794000000004
46 1 7.016109399999999 3.3882234000000007 3.1778134000000002
47 1 9.1175434 2.3570904 7.0728944
48 1 6.3152754 5.2685554 6.836283400000001
49 1 8.339528400000003 4.4576014 7.747800400000001
50 1 10.3109434 5.1497614 5.6956994000000005
51 1 7.8664654 1.5095364 8.849506400000001
52 1 9.795050400000003 1.3392214 10.129553400000002
53 1 7.3878144 3.6661644000000004 9.7070424
54 1 8.971327400000002 7.0529824 1.0876804000000002
55 1 9.913968400000002 10.1317134 0.7813031000000001
56 1 6.1825404 6.5896414000000005 4.9032334
57 1 8.5470164 6.3262834 4.4575954
58 1 7.200732400000001 9.3420634 3.5400004000000003
59 1 9.2406324 8.151507400000003 3.1530214
60 1 7.095097400000001 10.2901834 7.639194400000001
61 1 9.5990564 8.7306904 6.4404134
62 1 10.237613400000003 9.047647400000002 8.849239400000002
63 1 8.075448400000003 8.1689354 8.1464124
64 1 8.300732400000001 8.864912400000001 10.3945434
 
Masses
 
1 28.0855