33 Lattice="20.04785137604249 0.0 0.0 0.0 20.39858147638797 0.0 0.0 0.0 24.936179121564212" Properties=species:S:1:pos:R:3:initial_magmoms:R:1:forces:R:3:magmoms:R:1 energy=-3319.5937302354405 dipole="0.014734510476173628 -0.18808841830535553 30.766531723767297" magmom=0.0 free_energy=-3319.6129656437292 pbc="F F T" Zr 10.02440245 10.55272955 1.66391974 0.00000000 -0.00188660 0.00400819 0.04038433 0.00000000 Zr 10.02444497 10.55274761 4.51678750 0.00000000 -0.00230013 0.00366842 -0.03768274 0.00000000 Br 9.83687727 12.90538065 3.09184502 0.00000000 0.00041163 -0.00074123 -0.00341674 0.00000000 Br 12.38171193 10.44680742 3.09125389 0.00000000 0.00360766 -0.00133611 -0.00224393 0.00000000 Br 11.79519161 11.71546421 -0.20151093 0.00000000 0.00359961 0.00489645 -0.00216703 0.00000000 Br 7.71299650 10.07618941 3.08974838 0.00000000 -0.00215775 -0.00202339 0.00297294 0.00000000 Br 10.21141930 8.22571787 0.24396566 0.00000000 0.00326311 0.00086035 -0.00226166 0.00000000 Br 8.09188432 11.41755772 -0.20383318 0.00000000 0.00097794 -0.00079012 -0.00366926 0.00000000 H 10.12927075 9.22768752 3.09018790 0.00000000 0.00097502 -0.00093577 0.00038256 0.00000000 Zr 10.05210413 10.23308634 7.73483593 0.00000000 0.00220341 0.00530718 0.04098304 0.00000000 Zr 10.08183326 9.88081100 10.84838481 0.00000000 -0.00297157 0.00976769 -0.01483132 0.00000000 Br 9.88532391 12.24191702 9.59020232 0.00000000 -0.00067422 -0.00524998 -0.00333504 0.00000000 Br 12.06559721 9.08515269 9.20004840 0.00000000 0.00392828 -0.00408944 -0.00389375 0.00000000 Br 11.79483544 11.71624665 6.38294827 0.00000000 0.00032018 0.00123250 0.00281434 0.00000000 Br 8.26251223 8.76060492 9.19859406 0.00000000 -0.00544411 0.00018418 -0.00212719 0.00000000 Br 10.21203124 8.22571852 5.93605297 0.00000000 0.00331591 -0.00292256 0.00406411 0.00000000 Br 8.09302999 11.41791351 6.38570514 0.00000000 -0.00454155 0.00012014 -0.00008963 0.00000000 Zr 10.09392593 9.68285369 13.99544296 0.00000000 0.00226304 -0.00120116 0.01664431 0.00000000 Zr 10.09412178 9.68167845 17.12217258 0.00000000 -0.00238720 0.00513925 -0.01699285 0.00000000 Br 9.90419296 11.88422259 15.55903198 0.00000000 0.00082132 0.00390670 -0.00076618 0.00000000 Br 12.07500912 8.66547414 15.55815662 0.00000000 -0.00164432 -0.00259187 0.00368711 0.00000000 Br 11.94619824 10.97851030 12.50973306 0.00000000 0.00187503 -0.00076608 -0.00255765 0.00000000 Br 8.31295659 8.34580580 15.55893330 0.00000000 0.00008506 -0.00229374 -0.00066487 0.00000000 Br 10.27566581 7.56572183 12.29831957 0.00000000 -0.00043834 -0.00237267 -0.00171178 0.00000000 Br 8.05532409 10.65163524 12.50395056 0.00000000 -0.00130939 -0.00401990 -0.00053452 0.00000000 Zr 10.08046100 9.88448269 20.26835293 0.00000000 0.00046867 0.00131016 0.01958175 0.00000000 Zr 10.05225674 10.23436712 23.38213889 0.00000000 -0.00290697 -0.00150364 -0.03936752 0.00000000 Br 9.88438710 12.24414195 21.52872500 0.00000000 -0.00031355 -0.00181174 0.00157999 0.00000000 Br 12.06411415 9.08330695 21.91640867 0.00000000 -0.00136102 0.00369911 0.00268799 0.00000000 Br 11.94466253 10.98051537 18.60703440 0.00000000 0.00624778 -0.00001842 0.00327596 0.00000000 Br 8.26328055 8.76105542 21.91761568 0.00000000 -0.00843072 0.00314424 0.00529430 0.00000000 Br 10.27367882 7.56729854 18.82292737 0.00000000 0.00109851 -0.00386461 -0.00752540 0.00000000 Br 8.05421686 10.65358409 18.61196223 0.00000000 0.00310645 -0.00600007 0.00148738 0.00000000