64 Lattice="70.0 0.0 0.0 0.0 70.0 0.0 0.0 0.0 70.0" Properties=species:S:1:pos:R:3:forces:R:3 energy=314.43008825022133 stress="-0.0019655853294418394 -0.00023666726932446708 -0.0001306445336286214 -0.00023666726932446708 -0.0028219573126001527 -9.094109375009445e-05 -0.0001306445336286214 -9.094109375009445e-05 -0.0018779511990346532" free_energy=314.43008825022133 pbc="F F F" Cd 34.95084756 35.12345793 35.82085134 -10.94815348 -6.95022519 3.11861102 Zn 36.38914239 35.98423109 35.35661701 9.99069764 5.73973126 -4.83806652 Zn 37.25155851 37.97706579 34.85144603 -0.23870869 1.59456286 -0.30916832 Zn 39.30110475 38.58780258 36.18341856 -10.06983116 -10.60721230 3.66611021 Zn 37.16071294 34.89759912 37.22640386 -0.95104589 -1.89935331 -0.34273120 Cd 38.48163509 36.03071517 38.81714418 14.75870401 -30.05434641 -9.63617230 Zn 35.22090866 36.80615635 37.46765001 -0.02286980 0.03395485 0.13718872 Cd 35.62306117 38.49255704 39.41532573 7.13221907 -26.45497608 -12.73314702 Cd 40.47083304 35.29120314 35.47285928 -14.53737912 -10.14692854 -9.78138257 Zn 41.54299510 36.10983225 36.68295825 -52.13960603 71.15020576 -16.32844621 Te 42.02949117 37.21429510 35.00561772 5.79431348 9.77107655 -12.82138923 Te 43.37339357 39.17371640 36.29543444 10.78087437 -7.38361165 -12.75507651 Cd 42.20872602 35.24340527 37.08352754 60.24855847 -73.60817286 35.87607095 Cd 43.93418064 35.73673487 39.43427108 4.08175514 -5.33796375 -0.18580457 Cd 39.82859814 37.46904191 37.71336682 -2.95743403 -8.77505601 -4.40624861 Cd 41.05316113 39.07767879 38.36446533 -34.72083013 -21.97953799 13.75565193 Te 34.99092153 39.61270238 35.39553102 -5.96630355 -7.80465026 -5.67991664 Te 36.38920702 41.05224245 36.49511166 8.04658357 3.42771779 -1.76790723 Te 38.30899438 42.44964870 34.97412552 2.86528810 -6.61832882 -10.31220013 Zn 38.07915673 43.63559546 36.46590675 -1.10613858 7.86953062 8.50843858 Zn 37.11295732 39.51939181 37.98913490 4.27573216 -2.12993588 1.56727115 Zn 39.36133922 41.18362520 38.80000290 -7.75030400 -13.84103101 1.71980641 Te 34.54706481 42.38213373 37.40565744 -9.06633181 3.20422143 0.67483493 Cd 36.43251839 43.40557237 38.81467131 -37.35935146 57.52094159 -35.82202420 Zn 39.88718666 39.68980132 35.52704992 7.66989507 14.03764420 -9.65653982 Cd 41.27334659 41.72459326 36.47051569 -38.88615076 -18.03863589 36.43031778 Te 42.22666350 42.25289939 35.31725880 38.23239248 22.20406984 -47.25725566 Cd 43.98507569 43.68763743 36.76212464 2.07124053 2.32665356 -1.07946024 Te 42.29786485 40.06715157 37.89207830 30.93211415 36.29116927 -5.31672206 Cd 44.16824379 41.40949964 38.65681686 37.99473883 -40.29013293 -18.34602141 Cd 39.77868484 42.60560861 38.13535788 2.35335334 19.50978375 -4.51413681 Zn 41.19634382 44.06645705 39.56317100 -0.76816236 0.91706383 1.24436892 Cd 34.59552248 34.80094408 40.22884480 0.24935711 0.19662393 -0.02321948 Zn 36.58520243 36.32393771 41.74716111 -6.33369475 5.99800272 -9.97469206 Te 37.46557392 37.34442878 39.62864027 -12.19051776 11.15941124 10.53588236 Te 38.83462416 38.56536861 41.06522657 -16.05077199 -18.52196658 17.06760765 Cd 37.50645072 35.22853071 42.68111706 -8.03988356 -20.50301077 -7.66235897 Te 38.89358835 36.01340599 43.87781784 12.74295612 5.40080844 18.77095245 Cd 35.41374457 37.68315642 42.84857074 -26.35670741 -54.48290405 -14.70007700 Te 35.99087712 39.10119258 43.25602832 18.91187805 54.03640434 23.71079345 Cd 40.77738670 34.65965572 40.35785831 -6.26548114 -22.92732983 -21.35055150 Zn 41.07762066 35.68184630 41.35468285 5.95541992 20.94385326 18.26565854 Te 42.52996911 37.68036215 39.58229756 -3.72147527 -8.31148607 -1.37228871 Cd 43.45808496 38.60420838 41.38288910 8.34150185 -3.19980184 5.55281973 Zn 42.65876960 34.85981240 42.86636343 -14.59556101 -29.29333470 -18.92165227 Te 43.27836546 35.94267455 43.64318800 17.00843427 27.73861065 20.11806053 Te 40.56713965 37.65434272 42.88691646 -9.44526398 -29.52381523 -27.53492655 Te 41.10006797 38.89120336 43.94034826 14.49720057 35.41968895 31.00037244 Cd 34.66004333 39.86786347 39.92710743 -29.80952284 29.01360651 8.00255719 Te 36.34997162 41.27895662 40.88851501 -16.22970504 -8.01897409 13.03232976 Te 37.20345957 42.32820270 39.58698312 54.62573100 -34.40050382 15.38754502 Te 39.02111783 44.14584739 41.48376922 -7.74384493 11.37838785 -11.81747233 Zn 37.21987830 40.40161611 42.13163046 11.10544220 -9.07469047 7.42225812 Cd 38.79069931 41.12808171 43.48238362 -6.81817910 -13.18495099 8.05431422 Zn 34.80930839 42.31769197 41.88184344 -5.38262120 4.65251686 3.08452160 Zn 36.34373611 43.91559346 43.98857458 0.24336024 -0.17539070 -0.66147040 Cd 39.86913215 39.94897907 40.37080839 8.29326805 8.90801080 -5.43425363 Zn 40.79524050 41.35376160 40.37238551 12.02448564 15.74605820 1.96734794 Cd 43.29106704 42.66106923 39.28015874 -31.19224522 38.32434275 16.78953116 Zn 43.45622626 43.78181272 40.70270415 0.80196182 6.22312491 7.54826047 Zn 43.02462690 40.24742707 42.24088087 -2.68833677 3.01755545 0.14837412 Zn 42.98271007 41.70008267 43.32604816 0.12603080 5.20802629 3.45563034 Te 39.92730245 42.80117617 42.93826084 -11.72507990 -15.68423885 -23.61794016 Te 41.03622136 43.58345338 44.02528748 29.92200466 20.25913656 30.34723269