32
Lattice="6.0 0.0 0.0 0.0 6.0 0.0 0.0 0.0 6.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=2542.26509807 stress="-34.16779230968944 -0.16131524710609244 -0.17136575630444834 -0.16131524710609244 -33.20104038908314 -0.8082252972233114 -0.17136575630444834 -0.8082252972233114 -33.13414403559934" pbc="F F F"
K       0.05719733       0.27027626      -0.20671995    -119.71134054    -125.58865243    -103.59736066 
K       1.28510400       1.24458927       0.04990507      86.99830256      68.95296895     -83.08635889 
K       1.61224544      -0.12888246       1.68723373      49.85383285     -90.77699154     -29.60275006 
K      -0.04957479       1.31845710       1.31601751    -131.50588181      33.32380661      60.41984123 
K       2.83399913      -0.06946688      -0.27190523      22.24059798     -75.30314798     -84.77172364 
K       4.38348180       1.98932814      -0.01658535      98.63160669     -16.21553585    -128.73500532 
K       4.60989136      -0.04412655       1.15454496      91.78982473     -81.18973332     -28.10029609 
K       3.26531571       1.39633887       1.27328590     -55.66050519       0.89108557      34.80579958 
K       0.07022621       3.18066275      -0.29358810     -94.20680486       5.33497668     -70.08033643 
K       1.76767637       4.21243667      -0.20039844    -134.93908031     183.63484475     -94.12005125 
K       1.31063459       3.17842378       1.64553500      31.96625461     -99.65518573     -99.78484286 
K       0.14594781       4.45785282       1.74717822    -174.69750382     138.76541082     -94.70643375 
K       2.78013645       3.27652831      -0.26987588      90.96869934    -138.28129748    -132.21954412 
K       4.29215497       4.65055857       0.16186092     120.98773795      88.76348958     -77.54790743 
K       4.60385572       2.89694260       1.66900197     109.55485005      11.86353117      30.48350035 
K       3.01898035       4.32377323       1.25787668      -0.58677106     104.27658770      89.81978548 
K       0.29338723      -0.26651201       2.83184279    -122.91658337     -86.86097969      32.89484116 
K       1.41380054       1.73598149       3.19843311      10.09979660     -83.55412179    -104.63700315 
K       1.70500540       0.07855587       4.20693653     -39.90577126    -167.92000973      69.30056061 
K       0.14283106       1.31428451       4.76838441    -122.08811873     -36.46371602      95.91291431 
K       3.54906140      -0.26043140       3.13875033     -76.77794545    -191.40803902     -80.15940821 
K       4.34500492       1.02713464       3.22491354     135.32435329     114.31071267     -51.46204986 
K       4.46546017      -0.12324875       4.53607761     103.62240688     -85.20303551     164.08499464 
K       2.73867883       1.28243442       4.58968929      80.06324314      20.34695304     143.10247517 
K       0.21863911       3.01551126       3.23624620    -212.93645912     -55.85053047       2.79818437 
K       1.26322458       4.32386925       2.90022344      68.00907325     212.30508631      77.20359234 
K       1.55762453       2.75463684       4.59325006      -0.68499675      69.05028120     205.30152543 
K      -0.06073670       4.31382609       4.50882294     -77.36562183      87.01924139     102.91980034 
K       2.77434801       3.29645183       3.27852494      66.28527536     -24.02072709     -45.85072621 
K       4.48026295       4.45300620       3.15546484     102.43043834      95.67149817     -11.54094202 
K       4.41995536       2.71038052       4.30703665      97.79363003       7.40181548      92.86191530 
K       3.00879921       4.61434322       4.48775585      -2.63653958     116.37941351     118.09300965