32 Lattice="7.697859865092118 0.0 0.0 0.0 7.697859865092118 0.0 0.0 0.0 7.697859865092118" Properties=species:S:1:pos:R:3:forces:R:3 energy=-199.3496902005222 stress="-0.011816279744445048 -0.0011605489978452218 0.002106691099913671 -0.0011605489978452218 -0.012584205234830293 -0.000785657756195205 0.002106691099913671 -0.000785657756195205 -0.013162210104660559" free_energy=-199.3496902005222 pbc="F F F" Ta 0.01223970 0.00156828 0.01173134 1.43922313 1.29357479 1.31098114 Ta 1.92551194 1.95250124 0.00665353 -0.20724799 -0.30272554 -1.87069839 Ta 1.90596717 0.01642683 1.93987013 -0.05113681 -1.87143582 -0.21799578 Ta 0.03479791 1.91437402 1.89091007 -1.98095549 0.19909465 0.26585471 Ta 3.83272736 0.05174114 0.01146584 -0.42526124 -0.22318651 -0.10274253 Ta 5.79430947 1.91815748 0.05657058 0.11461145 0.54016487 -0.48581759 Ta 5.80300920 0.04362907 1.92806228 -0.00079664 -0.29759311 0.68205771 Ta 3.86124965 1.88096105 1.94108230 -0.23798783 0.53876837 -0.05916405 Ta 0.02064082 3.87404492 0.02518738 -0.17196010 -0.63681878 -0.27200632 Ta 1.90047605 5.78501483 0.06807108 0.74901287 0.18074729 -0.42303170 Ta 1.92130428 3.87677938 1.95311288 0.35055794 -0.56011886 -0.38867140 Ta 0.02342405 5.73732119 1.93071124 -0.79962737 0.71636297 0.39908127 Ta 3.83414238 3.83194385 0.01590121 0.32282741 0.40230334 -1.61849380 Ta 5.79883650 5.74971567 0.00179768 -1.50149746 -1.51144931 1.60268601 Ta 5.79025175 3.82306456 1.88907888 1.32059332 0.70873514 0.34008741 Ta 3.84298846 5.79801952 1.93525663 0.62163117 1.42131176 -0.13828694 Ta 0.00108285 0.04476747 3.83687368 -0.03448246 -0.20118457 -0.42331171 Ta 1.91948001 1.95357931 3.91094346 -0.27390722 -0.65884064 -0.79211104 Ta 1.92928553 0.02401981 5.77997634 0.19886111 -0.20433557 0.11947362 Ta 0.00828141 1.92642895 5.74020963 -0.36116565 0.51534115 0.37500132 Ta 3.81807255 0.01816091 3.86099472 0.66751903 -1.92120455 0.13510347 Ta 5.79330843 1.95172856 3.83679383 1.57376430 -0.14972801 0.52559907 Ta 5.79803833 0.02577253 5.78218947 -1.41088278 1.48971584 -1.57266810 Ta 3.86216471 1.87829166 5.78933271 0.66288941 0.21567562 1.82517777 Ta 0.01385221 3.88065120 3.83794803 -1.95339857 -0.14041098 0.64397445 Ta 1.89215579 5.80445519 3.82260919 0.32429406 1.75036884 0.93076355 Ta 1.94958333 3.81716174 5.78176413 -0.45170954 0.93177787 2.05471095 Ta 0.03193129 5.81118372 5.80083906 1.70268732 -1.62409965 -1.55482841 Ta 3.81651653 3.83968866 3.88430273 1.18521993 0.67833085 -0.08617485 Ta 5.77078899 5.76975885 3.83387264 -0.30875999 -0.54943948 -0.36131768 Ta 5.79309030 3.85179349 5.79385528 -0.58110933 -0.45565551 -0.38254726 Ta 3.83959702 5.78740815 5.78285188 -0.48180595 -0.27404646 -0.46068491