Triclinic periodic calculation

64 atoms
0.0 10.7125679 xlo xhi
0.0 10.7125679 ylo yhi
0.0 10.7125679 zlo zhi
0.0 0.0 0.0 xy xz yz
1 atom types
 
Atoms
 
1 1 1.7542769 2.4791759 0.9091594999999999
2 1 1.4170189 0.3159447 1.8096709000000002
3 1 4.637050899999998 1.1737229 0.44278829999999997
4 1 0.1768713 5.180669899999999 1.6359418999999997
5 1 3.8985859 3.2215598999999995 1.7003378999999998
6 1 3.7182349 2.2162899 3.9523598999999994
7 1 1.4530869 5.487868899999999 3.7271718999999996
8 1 0.9606929000000001 3.3551748999999997 2.9297128999999997
9 1 1.6150159 1.5754369 7.681181899999999
10 1 2.2624769 1.0350759 5.3957209
11 1 5.135868899999999 1.0156739 7.301422899999998
12 1 1.4923839 4.4727349 5.977603899999999
13 1 3.8875579000000005 3.8163769000000003 5.674673899999998
14 1 0.13421079999999996 0.5929365999999999 9.2349019
15 1 3.4984298999999996 1.0841119 8.982340899999999
16 1 0.6907213 4.0830419 10.238547899999999
17 1 2.0520449 3.8455318999999997 8.282847899999998
18 1 4.6828219 4.4340319 10.4825379
19 1 0.9295569000000001 7.423726899999999 1.2843588999999997
20 1 3.6006618999999995 6.271067899999999 0.7400148
21 1 4.7847439 9.076052899999999 1.9185829
22 1 4.491333899999999 5.814819899999999 4.545229899999999
23 1 5.2824868999999985 8.019851899999999 3.9931938999999996
24 1 1.2571569 10.1381679 3.9813358999999995
25 1 3.0119159 8.6241039 4.415588899999998
26 1 0.4371623 6.5948439 6.6398939
27 1 4.740986899999999 7.0455919 7.986904899999999
28 1 0.8964767 8.8094369 7.376995899999999
29 1 3.9853059 10.227417899999999 5.8755739
30 1 0.3658932 7.275862900000001 9.7639099
31 1 3.2032398999999994 5.7535449 9.1881629
32 1 1.4004218999999998 9.346911899999998 9.601157899999999
33 1 5.3170449 9.637059899999999 10.4077879
34 1 3.5791779 9.494149899999998 8.9132929
35 1 7.725482899999999 0.6333289 1.0530528999999997
36 1 5.813558899999999 0.42113619999999996 2.4437888999999995
37 1 8.098102899999999 2.9638258999999993 0.6537495
38 1 8.6915829 4.6468829000000005 2.3111309
39 1 9.513917899999997 2.7765229 3.4561658999999993
40 1 5.8625569 2.9518138999999994 4.5581068999999985
41 1 5.5698789 4.5707739 2.8607828999999994
42 1 8.712784899999999 4.6090259 4.718842899999999
43 1 6.937850899999999 1.2774269 5.8329328999999985
44 1 9.2531369 0.7382356 5.8539908999999986
45 1 8.8873599 3.4446319 7.661011899999999
46 1 10.2210279 3.0019128999999998 5.7462969
47 1 6.5917359 1.8088679 10.0055579
48 1 7.248255899999999 5.0655249 8.1504919
49 1 9.693430899999997 2.6204509 9.688929899999998
50 1 6.882381899999999 8.0002919 2.2123029
51 1 5.940553899999999 6.0870299 1.0211399
52 1 9.5931139 8.245152899999999 0.5332597
53 1 9.8677349 10.3723779 1.5539259
54 1 8.458529899999998 8.0316569 4.1514419
55 1 10.174567899999998 6.436995899999999 4.500017899999999
56 1 6.007725899999999 10.2116579 4.6310879
57 1 9.5887299 10.103227899999998 3.9073309
58 1 7.4508319 7.939643899999999 6.3417419
59 1 6.0588419 6.029353899999999 6.3519169
60 1 9.6526909 10.042787899999999 7.686346899999999
61 1 6.5196909 6.8494098999999995 9.5026229
62 1 8.9642469 6.5524669 7.5020009
63 1 6.6624579 10.5359779 8.704128899999999
64 1 8.109077899999997 8.4994099 8.691773899999998
 
Masses
 
1 28.0855