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=106.94962119092915 stress="-0.0006850062708394128 -0.00023788952775954058 -0.00011681788713203246 -0.00023788952775954058 -0.0007302341451878715 -0.00015755310780127632 -0.00011681788713203246 -0.00015755310780127632 -0.0007854081792816202" pbc="F F F" Cd 35.23644935 35.69928761 34.92357065 -2.74193132 -1.40547177 -2.39623925 Cd 36.67857306 36.41454364 36.26479014 -1.12944924 -1.72469091 7.76637094 Cd 37.62866999 37.19299764 34.86081947 3.64268194 3.14497071 -6.75971592 Cd 38.97274362 38.26935394 36.55242548 -0.62455991 2.50510919 -2.72549981 Cd 37.78185564 34.67423500 37.70609579 -2.48101288 -4.97009224 -1.91676759 Cd 38.67647898 36.25179889 38.49469792 -23.72162463 -1.62761871 -3.33073149 Cd 34.70411959 37.32006286 37.49479186 -0.63619269 0.37995152 0.39370683 Cd 36.65674937 38.72225598 38.96562791 -9.90138173 -7.21320829 6.87184474 Cd 39.36808541 34.79039036 35.03943152 0.04011360 0.11138930 0.18358535 Cd 41.60760404 36.71522721 36.00439459 -8.00392450 -2.66910331 6.50688706 Cd 42.80820902 37.21963622 34.80539633 4.85742915 -3.46756438 -11.75217969 Cd 43.35320685 38.69151616 35.79642907 3.15748353 6.35380725 3.66902934 Cd 42.70438499 35.07550802 37.42010011 -7.31951329 -3.51286867 -6.30129820 Cd 43.95988817 35.55395512 38.58168652 8.40654401 1.37405798 5.42548849 Cd 39.86354409 37.00203356 37.88688112 15.69003447 7.11241778 -10.47460610 Cd 41.22901731 37.96057156 38.91271192 2.94781852 3.22419394 2.59486159 Cd 35.31841281 39.94751650 34.92139371 -4.99100609 -7.37377837 -11.95575342 Cd 35.88921942 40.75121598 36.27048984 4.34122109 5.10700681 12.24755177 Cd 37.36291080 42.31530757 35.40565462 -2.18508584 -2.39546489 -2.55508854 Cd 38.66825602 43.61230136 36.17752589 2.73114419 3.74012500 1.64338628 Cd 37.81616470 39.60694090 38.12148993 8.29834160 6.83647564 -7.14097486 Cd 38.81343399 41.37996245 39.19332522 -11.23965097 7.25622275 -2.99089715 Cd 35.29863537 42.59929664 37.76987678 -1.50136227 -1.24373953 -1.56797135 Cd 36.20927968 43.80165555 39.28203635 -3.71540671 4.67715601 -0.78665151 Cd 40.08600622 40.09291877 34.97837561 -2.40896869 -2.18897306 -2.10041323 Cd 41.37947793 41.32724573 36.02390838 1.43593663 0.99309019 -0.16913527 Cd 42.67516084 42.81934740 34.90095341 -0.65895014 0.47474650 -2.56713394 Cd 44.17933998 43.49958023 36.38221859 1.55767125 0.68077787 1.77658351 Cd 42.35732875 40.02363536 37.53640482 0.29742907 -0.86154215 2.24573211 Cd 43.78552162 41.78456622 38.91102365 3.79793829 -0.76655012 -2.35192563 Cd 40.39090109 42.55800575 37.55517182 -7.35713530 -11.14944282 -13.16095981 Cd 40.93842517 43.49120044 38.68450067 5.81031882 13.95848022 13.35730640 Cd 34.69623333 35.09264207 39.62069918 -1.93922365 -1.46674235 -2.34269696 Cd 35.98385435 36.03697222 41.01476175 3.09426155 -1.26595415 -2.11722432 Cd 38.32297114 37.15983348 40.24344789 -4.69304525 -4.38498711 2.27777306 Cd 38.86439874 38.81754574 40.80695144 -3.69979867 12.23931097 -12.27547221 Cd 37.40284988 35.30281345 42.73515741 -8.42243324 -6.21555521 -2.70993770 Cd 38.81399505 36.17293429 43.28900512 9.26645384 5.23269982 3.91987450 Cd 35.19919299 37.37281203 42.29518508 -2.39544044 3.10218236 2.18992226 Cd 36.47411676 38.36220764 44.12458466 -0.28674393 -0.54214684 1.67950182 Cd 39.63213332 35.45906900 39.58604388 10.32015671 -10.41374520 11.29622126 Cd 41.71914856 35.95897652 41.31478537 -3.15890692 6.85053729 -8.38939169 Cd 43.11141030 37.02296614 40.00842636 1.71730929 2.09431791 0.44682735 Cd 43.30991366 39.49376248 40.90993399 0.69820838 -0.07173986 -0.81840743 Cd 41.90560639 34.91104901 42.66262059 1.27529800 -7.73762588 10.07939685 Cd 44.11494048 37.03250730 43.34901089 -0.17699493 0.13259734 -0.14277795 Cd 39.53578513 38.28982213 42.20214372 8.18858242 -5.83629353 12.16861363 Cd 41.03114083 38.40301596 43.96221421 -0.81704868 -2.68465563 2.97691829 Cd 34.64764578 40.29368674 40.22025637 -8.20162490 -7.94873906 -6.55991397 Cd 35.76725030 41.31538150 41.04482210 24.46787274 -10.01902182 -16.56899072 Cd 37.69533077 42.96134477 40.16611730 -7.72572618 -10.88092560 -5.09315316 Cd 38.74400789 43.85374949 40.99859303 11.52987265 10.40569441 8.76680994 Cd 37.83441729 39.63152362 42.72060691 -5.54759537 -23.15251608 -14.21924553 Cd 38.02203770 40.87344837 43.42953345 3.41120004 25.47231890 14.88926362 Cd 35.06317802 42.05658407 42.02745244 -15.96655930 17.51435474 23.07234908 Cd 36.86386531 43.52529741 43.85800212 0.12976799 0.04534328 -0.13011981 Cd 40.17728387 40.49566835 39.49903200 10.64728358 -9.95252454 -0.15791597 Cd 41.37884593 41.38629877 40.92536678 -13.00931191 -14.94784815 20.12544027 Cd 42.13986266 42.24044499 40.02333546 12.95552469 16.59783186 -13.70902778 Cd 44.16810445 43.47255235 41.55991248 -0.03699718 -0.04401388 0.11612705 Cd 42.07750744 39.91232844 42.95970628 -0.18174602 1.04920859 -1.73870701 Cd 43.41958417 41.36824608 43.96595278 1.34944930 1.62261088 0.93270133 Cd 39.80882088 42.45127958 42.75126359 -5.41758974 -7.31960045 -3.81703171 Cd 40.85683667 43.69242952 43.48512663 6.23059521 7.16575756 4.17388191