Triclinic periodic calculation 64 atoms 0.0 10.5412 xlo xhi 0.0 9.14864 ylo yhi 0.0 10.8232 zlo zhi -5.30912 0.0543286 0.019795 xy xz yz 1 atom types Atoms 1 1 -0.286699 0.153382 0.373585 2 1 -0.18705399999999997 0.367397 2.8591699999999998 3 1 -0.118437 0.045237 5.29812 4 1 0.161464 0.20478500000000002 7.785120000000001 5 1 -1.3194300000000003 2.2718600000000007 0.0564818 6 1 -1.27142 2.1522 2.24599 7 1 -1.3375400000000002 2.3252700000000006 5.2183 8 1 -1.06279 2.2420800000000005 8.02228 9 1 -2.54101 4.69741 0.06152760000000001 10 1 -2.56902 4.80047 2.86272 11 1 -2.84351 4.68844 5.450900000000001 12 1 -2.6594400000000005 4.566470000000001 7.82922 13 1 -3.75335 6.86254 -0.00837524 14 1 -4.019790000000001 6.84927 2.12554 15 1 -3.98123 6.86615 5.186550000000001 16 1 -4.160310000000001 6.92891 7.398910000000001 17 1 2.60746 -0.06362409999999999 -0.31030500000000005 18 1 3.0404500000000003 -0.09250710000000001 2.3847400000000003 19 1 2.6160499999999995 0.0593251 5.65186 20 1 2.61477 0.0296499 7.78516 21 1 1.3214499999999996 2.17028 0.012644900000000002 22 1 1.60396 2.15959 2.52799 23 1 1.30724 2.30873 5.39167 24 1 1.26384 2.35954 7.59895 25 1 -0.10494800000000076 4.586900000000001 -0.469244 26 1 -0.08771490000000079 4.73441 2.39274 27 1 -0.011622100000000342 5.05796 5.315760000000001 28 1 0.22085100000000002 4.43169 7.92722 29 1 -1.1327000000000007 6.75825 0.18751800000000002 30 1 -1.4717900000000006 6.51111 2.84724 31 1 -1.1941500000000007 7.05782 5.14551 32 1 -1.3589700000000013 6.8173 7.869390000000001 33 1 5.259959999999999 -0.0649457 -0.0171645 34 1 5.272659999999999 0.018807600000000004 2.88871 35 1 5.1805 -0.001193859999999998 4.74664 36 1 5.18778 0.22366500000000003 7.83523 37 1 3.9042399999999993 1.94181 0.0870598 38 1 4.04699 2.3600100000000004 3.0742000000000003 39 1 3.744439999999999 2.62006 4.95649 40 1 3.71365 2.0193800000000004 7.65747 41 1 2.655709999999999 4.63737 0.230889 42 1 2.42179 4.76107 2.76443 43 1 2.799829999999999 4.577510000000001 5.20168 44 1 2.625120000000001 4.604329999999999 7.8204 45 1 1.3271600000000001 6.84668 -0.35896500000000003 46 1 1.2289100000000004 6.94561 2.6199 47 1 1.3276999999999988 6.784230000000001 5.4337599999999995 48 1 1.3246599999999993 6.857980000000001 7.908710000000001 49 1 7.905879999999998 0.00998967 -0.16703 50 1 8.026260000000002 0.20687400000000003 2.33479 51 1 7.912270000000001 0.169129 5.31396 52 1 7.856760000000001 0.0210477 7.548870000000001 53 1 6.9418799999999985 2.3879799999999998 0.285476 54 1 6.94129 2.5064300000000004 2.80075 55 1 6.631630000000001 2.336660000000001 5.641309999999999 56 1 6.300230000000002 2.4230099999999997 8.07149 57 1 5.222989999999999 4.559470000000001 -0.0816771 58 1 5.20287 4.48787 3.0649599999999997 59 1 5.00356 4.278660000000001 5.27795 60 1 5.187709999999998 4.6439200000000005 7.97119 61 1 3.8915200000000003 6.59134 0.00694915 62 1 3.938639999999999 6.86941 2.98575 63 1 3.980980000000001 6.865540000000001 5.00501 64 1 3.9077799999999994 6.99502 7.6091500000000005 Masses 1 28.0855