16 Lattice="7.66117 0.0 -0.023755 0.0 7.278451 0.0 -1.199712 0.0 10.564712" Properties=species:S:1:pos:R:3:forces:R:3 energy=-52.02972647354872 stress="-0.003122075449140571 1.1520144788988639e-07 -1.5280038622127617e-05 1.1520144788988639e-07 -0.0026479029770092354 3.3255987032231696e-07 -1.5280038622127617e-05 3.3255987032231696e-07 -0.0030235919497454532" dipole="0.00012791486374778003 -0.00010795362473591544 -0.00023732479816690742" pbc="T T T" Al 1.44237000 4.29720000 0.53648000 -0.01251234 0.04589302 -0.01870647 Al 5.61895000 0.65797000 4.72211000 0.01243460 0.04591162 0.01875046 Al 0.84250000 6.62048000 5.81884000 -0.01230707 -0.04597271 -0.01866706 Al 5.01910000 2.98125000 10.00447000 0.01239684 -0.04586669 0.01876593 Br 1.90150000 6.46843000 0.11584000 -0.00057166 -0.03446055 0.00615777 Br 6.86138000 4.12792000 1.49567000 -0.02546861 0.00950314 0.02537079 Br 2.85299000 3.02356000 1.75679000 0.01955487 -0.01705394 0.01271980 Br 4.20832000 6.66277000 3.50182000 -0.01952365 -0.01702926 -0.01272175 Br 0.19994000 0.48870000 3.76294000 0.02549617 0.00951854 -0.02546565 Br 5.15982000 2.82920000 5.14276000 0.00056854 -0.03447737 -0.00617505 Br 1.30165000 4.44924000 5.39820000 -0.00061773 0.03461936 0.00619019 Br 6.26152000 6.78976000 6.77802000 -0.02550254 -0.00953486 0.02544431 Br 2.25314000 0.61567000 7.03915000 0.01944943 0.01696640 0.01264361 Br 3.60847000 4.25490000 8.78417000 -0.01950377 0.01700286 -0.01268790 Br -0.39992000 3.15053000 9.04529000 0.02552435 -0.00952155 -0.02544379 Br 4.55996000 0.81002000 10.42512000 0.00058266 0.03450193 -0.00617516