# LAMMPS data file written by OVITO 64 atoms 1 atom types -8.8485004 6.1514998 xlo xhi -5.5669999 9.4330006 ylo yhi -7.3570004 7.6429997 zlo zhi Atoms # charge 1 1 0.0 -0.869 -1.564 0.797 2 1 0.0 -0.645 -1.865 0.197 3 1 0.0 -1.683 0.065 -1.6590001 4 1 0.0 -1.532 0.504 -1.1260001 5 1 0.0 -1.142 2.1440001 0.838 6 1 0.0 -0.855 2.3810001 1.4400001 7 1 0.0 -0.886 4.3470001 -0.614 8 1 0.0 -0.765 4.6529999 -1.24 9 1 0.0 -6.3390002 1.736 1.11 10 1 0.0 -5.7750001 1.444 1.423 11 1 0.0 -5.8210001 0.148 -0.914 12 1 0.0 -5.2839999 0.061 -1.368 13 1 0.0 -6.1929998 -2.28 0.182 14 1 0.0 -5.4889999 -2.3269999 0.239 15 1 0.0 -5.9250002 3.4820001 -0.81 16 1 0.0 -5.3670001 3.422 -1.2410001 17 1 0.0 -3.3039999 -0.645 0.461 18 1 0.0 -3.767 -0.542 0.985 19 1 0.0 -3.651 1.742 -0.323 20 1 0.0 -3.5750001 2.062 0.303 21 1 0.0 -3.148 4.6420002 0.64 22 1 0.0 -3.3529999 4.6149998 -0.036 23 1 0.0 1.129 5.7189999 0.553 24 1 0.0 1.235 6.0739999 -0.05 25 1 0.0 -1.402 6.638 0.75 26 1 0.0 -1.2460001 6.9510002 0.135 27 1 0.0 -3.7019999 7.0549998 -0.944 28 1 0.0 -3.7660001 7.4239998 -0.343 29 1 0.0 -5.6030002 5.8730002 0.515 30 1 0.0 -6.25 6.0430002 0.7480001 31 1 0.0 3.339 1.231 0.427 32 1 0.0 3.342 1.328 -0.274 33 1 0.0 0.974 0.009 -0.453 34 1 0.0 0.775 0.476 0.039 35 1 0.0 1.245 2.9460002 -0.557 36 1 0.0 1.24 3.0339999 0.145 37 1 0.0 3.642 4.013 0.163 38 1 0.0 3.398 4.5409999 -0.24 39 1 0.0 -2.619 -3.5580001 -0.112 40 1 0.0 -3.052 -3.0550001 -0.354 41 1 0.0 -2.2550001 0.346 2.7950001 42 1 0.0 -2.1949999 0.437 3.494 43 1 0.0 0.287 0.23 2.48 44 1 0.0 0.476 0.71 2.964 45 1 0.0 1.7180001 -1.798 3.2520001 46 1 0.0 1.564 -1.578 3.9070002 47 1 0.0 -2.8440002 3.1760001 2.7890001 48 1 0.0 -3.3239999 2.675 2.927 49 1 0.0 -5.3000002 3.944 2.0539999 50 1 0.0 -5.6269999 4.006 2.6789999 51 1 0.0 -4.0300002 4.844 -3.6210001 52 1 0.0 -3.895 5.1020002 -2.9760002 53 1 0.0 -2.915 2.6540001 -2.6429999 54 1 0.0 -2.6530001 3.0810001 -2.1429999 55 1 0.0 -0.468 2.076 -3.1949999 56 1 0.0 -0.277 2.3759999 -2.582 57 1 0.0 1.7460001 0.786 -3.1300001 58 1 0.0 1.954 1.169 -2.5720001 59 1 0.0 3.286 -0.98 -1.877 60 1 0.0 2.694 -1.361 -1.957 61 1 0.0 2.998 -1.8380001 0.629 62 1 0.0 2.747 -1.267 0.961 63 1 0.0 -6.2600002 6.1199999 -2.6370001 64 1 0.0 -6.217 5.8870002 -1.97