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=395.745798115865 stress="-0.0015077331846083091 -7.043332173464904e-05 -0.0001004330251841044 -7.043332173464904e-05 -0.0014166181439061948 -2.8250378814138012e-05 -0.0001004330251841044 -2.8250378814138012e-05 -0.0014930570104959085" pbc="F F F" Rb 34.75900849 35.18525799 35.18408192 -3.95919735 -2.49247664 -2.43705916 Rb 36.59933616 35.93572417 35.98055861 -1.18164599 -4.06679542 -1.45848628 Rb 36.94667287 37.22516294 35.23402360 -0.43145917 2.58456258 -6.21733080 Rb 38.84207182 38.57916672 35.96390753 -0.67244085 0.89687621 -5.43880105 Rb 37.29465675 34.93158033 37.83765651 -1.81984730 -6.35932903 -0.19338057 Rb 38.85840215 35.76443239 38.11272147 1.57988938 -3.91226509 0.13193828 Rb 34.64671032 37.87128473 37.80973961 -5.43297718 -0.93264523 -1.36705700 Rb 36.55604684 39.07636534 38.99475015 -4.13440166 0.75143800 -2.01439246 Rb 40.44932342 35.29377055 34.75670798 -0.75112590 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42.83814538 37.63905551 -4.68901275 2.06085411 -2.93827158 Rb 35.90975672 43.66349090 39.11824152 -1.86027795 6.05479215 0.88480971 Rb 40.69525584 40.22752116 34.70305829 -0.74150670 -0.04073464 -6.32273906 Rb 41.72578650 41.12475624 36.46651109 -0.18493782 2.36694474 -2.72337930 Rb 42.47016956 42.97130329 35.10350000 0.47607776 2.86352264 -4.92554795 Rb 43.97271432 43.46171569 36.58326049 3.93033461 3.26957679 -0.10544461 Rb 42.58087455 40.09122498 37.14978212 4.35232571 -2.72774456 0.92739991 Rb 43.97769358 41.35334066 38.54532507 5.76418214 -0.07766234 1.25868275 Rb 39.66448343 42.68403127 37.11226018 2.26338914 2.09692160 -1.70841834 Rb 40.58497151 43.31914392 38.89352680 1.09681967 6.67352345 -0.63293153 Rb 35.05615299 35.04331559 39.34728750 -4.58321720 -3.70575255 -0.38050315 Rb 36.18959060 36.09305905 40.84266193 -2.95203797 -1.72121176 1.21690884 Rb 37.49911544 37.99791377 39.62151619 0.03404277 -4.15284388 0.23674507 Rb 38.52273129 38.51894432 41.34725891 0.03169012 -2.20398210 2.28256092 Rb 37.07742728 34.96989052 42.36669775 -1.99580355 -4.66916532 3.43411196 Rb 39.08450338 35.75571598 43.58475277 -0.47388572 -3.59741126 5.70910129 Rb 34.99655912 37.96978731 42.51668654 -6.01724872 -2.19426404 1.45742737 Rb 36.22422232 38.91950201 43.54655608 -3.10664023 -1.15621448 6.84196523 Rb 39.29950088 35.00137669 40.69522847 -0.91287403 -5.08401804 -0.22795535 Rb 41.43855876 35.51198686 40.96331241 -0.67199985 -2.19719893 -1.18619359 Rb 42.84911873 37.01757136 39.91996436 1.42035238 0.88016891 1.70376884 Rb 43.60556472 38.49425818 41.03735392 5.25322633 1.62654942 1.66276483 Rb 42.20384740 34.85081933 42.03810700 3.62777304 -5.77242947 4.59435728 Rb 43.64763455 36.27401265 44.00814638 2.18844656 -0.44571263 2.74305295 Rb 39.84711061 37.35418500 42.77385137 1.47075454 -0.75111825 2.88210975 Rb 40.94042883 39.08426327 43.80462855 1.62872242 -0.94557187 5.88175282 Rb 34.83286624 39.70558043 39.93496123 -7.27555650 0.39245259 0.72615970 Rb 35.88698845 41.61356488 40.86193449 -4.14593973 0.84302709 1.37487540 Rb 37.82350393 42.21827495 40.29659783 -3.10869773 2.43678581 -0.17482788 Rb 38.90018420 43.28337470 40.87827378 0.14315629 8.71745291 2.21624532 Rb 37.34507354 39.94186987 42.87644269 -1.27205333 2.18666814 2.97390994 Rb 39.00130655 40.79357549 43.78505241 -0.06680389 1.97355623 6.85359870 Rb 34.62935593 42.80367007 42.32271401 -4.79212845 1.69395145 2.12784957 Rb 36.60397116 43.79540286 43.37563583 0.05209694 3.13868493 3.22132999 Rb 39.50493887 40.15017002 40.36805486 1.38139755 -2.45425558 1.63615884 Rb 40.89974943 41.22892384 41.12165250 5.17615335 -0.89414448 -0.73173134 Rb 42.34497277 42.80178516 39.71375535 4.35086007 3.28244160 0.63205693 Rb 43.96837464 43.91658749 41.72203415 2.62624083 2.33308789 0.82415455 Rb 42.51989586 40.11435160 42.44053329 3.98551343 -0.18421195 1.64486566 Rb 43.82327501 41.24617305 44.08965562 2.98463293 0.93802635 3.12991131 Rb 40.37368119 42.11536967 42.13716159 0.67275234 4.98189905 6.14746694 Rb 40.97456904 44.06242240 43.78359587 0.51163234 3.31048672 2.98549519