Triclinic periodic calculation

64 atoms
0.0 10.5774 xlo xhi
0.0 9.41396 ylo yhi
0.0 10.4512 zlo zhi
-5.5435 0.064938 0.0467405 xy xz yz
1 atom types
 
Atoms
 
1 1 0.236369 0.26893 0.312575
2 1 -0.46845699999999996 -0.05515330000000001 2.71797
3 1 0.155919 0.092588 5.15124
4 1 -0.018441000000000003 0.0929563 7.82273
5 1 -1.55477 1.9758099999999998 -0.267213
6 1 -1.04358 2.17509 2.21266
7 1 -1.4028400000000003 2.0828800000000003 5.10665
8 1 -1.5319299999999998 2.4726199999999996 7.672319999999999
9 1 -2.5255700000000005 4.36371 -0.0687127
10 1 -2.6316799999999994 4.785879999999999 2.11088
11 1 -2.8284999999999996 4.663869999999999 4.81651
12 1 -2.43747 4.62598 7.375969999999999
13 1 -4.03263 6.852329999999999 0.012940899999999998
14 1 -3.84994 6.83623 2.55746
15 1 -3.9877799999999994 6.9554599999999995 5.08975
16 1 -4.044370000000001 7.15345 7.9847399999999995
17 1 2.7925 -0.150709 -0.23691199999999998
18 1 2.52744 0.0585484 2.75097
19 1 2.97937 0.0253826 4.990239999999999
20 1 2.7917799999999997 -0.12576499999999996 7.78546
21 1 1.1725699999999997 2.07204 0.331708
22 1 1.3093999999999992 2.34381 2.76563
23 1 1.18538 2.29758 5.233549999999999
24 1 1.5962499999999997 2.2363999999999997 7.51626
25 1 0.209736 4.7052 -0.38166
26 1 0.021217799999999724 4.791080000000001 2.50518
27 1 0.14277999999999944 4.68614 5.40679
28 1 0.0689267 4.99276 7.69231
29 1 -1.3011300000000001 6.8413900000000005 -0.125401
30 1 -1.321290000000001 6.9098 2.46812
31 1 -1.4075700000000004 6.90228 4.65006
32 1 -1.5132600000000003 6.89042 7.78065
33 1 5.65863 -0.11901200000000002 -0.254989
34 1 5.10197 -0.169957 2.56638
35 1 5.09243 0.20331299999999997 5.33098
36 1 5.4779 0.04045030000000001 7.674869999999999
37 1 4.26427 2.4375200000000006 0.163886
38 1 3.8285699999999996 2.25448 2.19664
39 1 4.056579999999999 2.3343099999999994 4.68086
40 1 4.02669 2.41042 7.337839999999999
41 1 2.701970000000001 4.51023 -0.181109
42 1 2.6902099999999995 4.95442 2.77602
43 1 2.7630200000000005 4.59982 5.27878
44 1 2.51118 4.74862 7.54636
45 1 1.3288699999999996 6.836 -0.11303
46 1 1.2088699999999988 6.937809999999999 2.2634399999999997
47 1 1.347940000000001 6.78344 4.99463
48 1 1.1865999999999997 6.825780000000001 7.72723
49 1 7.89632 -0.0170417 0.0255252
50 1 7.535309999999999 0.006565630000000001 2.9332799999999994
51 1 7.7535099999999995 0.543148 5.152539999999999
52 1 7.57049 -0.04040420000000001 7.959989999999999
53 1 6.604229999999999 2.27111 -0.0474532
54 1 6.37919 2.09166 2.92245
55 1 6.73055 2.3028700000000004 5.301029999999999
56 1 6.5807199999999995 2.3660400000000004 7.688570000000001
57 1 5.17021 4.6802 0.219605
58 1 5.33653 4.416619999999999 2.4453300000000002
59 1 5.281230000000002 4.72183 5.09151
60 1 4.9532799999999995 4.74786 7.557189999999999
61 1 4.067660000000001 6.868319999999999 -0.154912
62 1 3.74255 7.04003 2.54371
63 1 3.95151 7.01529 5.08037
64 1 3.4921700000000007 7.048539999999999 7.79727
 
Masses
 
1 28.0855