864 Lattice="21.134911404023235 0.0 0.0 0.0 21.134911404023235 0.0 0.0 0.0 21.134911404023235" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-2505.312514042583 pbc="F F F" Ni 0.00540551 0.00928898 -0.02261038 28 0.72970712 0.86384567 1.10011808 Al 1.73658831 1.79464765 -0.00847251 13 -0.56230533 0.09868145 -1.55448246 Al 1.77679893 -0.00850399 1.75984135 13 -1.16754695 -1.78748304 -0.66433978 H -0.00133791 1.77441039 1.72410017 1 -0.68356415 -0.31162008 -0.19054339 Al 3.50467035 -0.02025185 0.01817912 13 0.56110051 -0.18112411 -1.42323779 Ni 5.28355950 1.80840817 0.01929114 28 -0.31955707 -0.34057625 0.15283233 Al 5.28679879 -0.01696009 1.74320997 13 0.93266790 -0.12431759 0.07829928 Ni 3.54016404 1.75548185 1.77547699 28 0.67940897 0.59752716 0.01600772 H 7.06672411 -0.01019904 0.00470685 1 -0.10493964 -0.20831240 -0.16184669 Al 8.78216364 1.74094514 0.00806969 13 1.49102820 -0.73925418 -2.45962020 Al 8.77015665 0.02049756 1.76384029 13 0.33552149 -0.54948064 0.49673727 Al 7.05288425 1.79459772 1.73237354 13 -1.70921023 -0.73132411 2.07993681 H 10.55975672 -0.00827046 -0.02098261 1 0.40175680 0.01643323 0.45492899 Al 12.29791050 1.77153331 -0.00770980 13 0.18403545 -0.01956272 0.47457333 Ni 12.33118713 -0.02566418 1.76686327 28 0.50619894 2.22346820 0.33740982 Ni 10.55338854 1.82233284 1.75787386 28 0.48118831 -0.17050354 1.10846038 H 14.08573888 0.01258694 -0.00715487 1 0.11772984 -0.05698609 0.74526563 H 15.85942357 1.77703888 0.00570581 1 0.53088676 -0.37131466 0.14855970 Ni 15.82532167 -0.00831686 1.75358003 28 -0.32682155 2.35260441 -0.06731538 H 14.15119824 1.77565505 1.75092451 1 0.10024635 -0.60105892 -0.27904144 Ni 17.65345769 0.01708128 -0.03341671 28 -0.26862624 1.90678956 1.99076349 Al 19.39037369 1.78620482 -0.01212601 13 -1.44202224 -0.20234011 0.70119752 H 19.34483819 -0.02418661 1.79295467 1 -0.59860084 0.19841569 -0.45796359 H 17.65213775 1.77323721 1.74205451 1 0.04480728 -0.34431196 -0.50086439 H -0.00675196 3.56214627 0.04117446 1 -0.29913383 0.29985398 0.04577000 H 1.79139758 5.29866449 0.05134221 1 0.30036697 0.33092942 -0.05138792 Al 1.77283336 3.51061472 1.73724407 13 0.33143781 1.20050346 0.31988369 Al -0.00136114 5.31029409 1.75650827 13 1.33202840 0.52959413 0.40206360 Ni 3.53682867 3.49114289 0.00206728 28 0.44271991 0.89649369 0.85302003 H 5.29091890 5.24869243 -0.00371173 1 -0.35309845 0.19313027 0.17341236 Ni 5.28619394 3.51635468 1.76245631 28 -0.44207900 1.03084318 0.71878666 H 3.49453618 5.27597952 1.78444411 1 0.23391664 -0.09665661 -0.50371934 Al 7.01773212 3.52584971 -0.01982750 13 -1.22683605 1.73781647 -1.50299815 H 8.78115067 5.28472697 -0.01583546 1 0.10503065 0.29477338 -0.34048394 Al 8.77694173 3.50758602 1.75831899 13 1.55154797 1.72486481 1.62118463 H 7.03564118 5.26029730 1.76448721 1 -0.60262151 0.05884679 -0.05126460 Ni 10.53068895 3.53897978 0.03034814 28 0.24733196 0.58039169 0.56072390 Al 12.31981050 5.29369964 0.01134413 13 -0.02203211 -1.09330916 0.18316866 Ni 12.32331096 3.56452670 1.76601612 28 -0.24229378 0.05899202 0.75194907 H 10.59763455 5.25687371 1.76800338 1 0.39312287 -0.58453961 -0.61745374 Ni 14.09881073 3.52532929 -0.01651386 28 -0.03290097 -0.11354309 1.17326732 Ni 15.84721542 5.30312433 -0.00272286 28 0.60485767 0.08522961 0.98283188 Al 15.82902655 3.57664880 1.73293751 13 1.07982546 -0.39469907 -0.63727793 H 14.11450585 5.28315334 1.74396253 1 0.23670060 -0.50508473 -0.60901714 Ni 17.63165155 3.51719436 -0.02631389 28 -0.18847202 -0.10250707 1.48698470 Ni 19.39613639 5.27760277 0.03198216 28 -1.76246307 0.18240783 1.63398795 Al 19.39078893 3.49694623 1.78210107 13 -1.58057111 0.60052767 0.51611027 H 17.64243506 5.27699743 1.76600727 1 0.35858632 -0.38825373 -0.93420002 H -0.00677498 6.99186182 0.04147078 1 0.09195823 -0.02900111 0.18724336 Al 1.75612629 8.81115339 0.01320588 13 -1.11929869 -0.31445161 0.63672012 H 1.76697031 7.02308741 1.79515318 1 -0.38211015 -0.49798533 -0.57526587 H -0.02264816 8.82550452 1.74123020 1 -0.09979939 0.36128909 -0.72899592 Ni 3.50503446 7.01647750 0.03435777 28 -0.18262541 -1.10476377 1.28582279 Al 5.29692075 8.77477950 0.02543471 13 0.71165986 -1.06779006 -1.69935590 Ni 5.27655438 7.05758323 1.79731246 28 0.80410958 -1.83151676 0.15312829 Al 3.53249717 8.75511957 1.77691378 13 -1.56313120 0.17469027 -0.76393520 Ni 7.03320448 7.01105870 0.00615900 28 0.02395714 -0.48892917 0.98935951 Ni 8.83395383 8.82587487 -0.01132861 28 -0.03113097 0.27387024 0.44027248 Al 8.80209799 7.02336680 1.77821411 13 -1.26695123 -1.23230812 -0.13903328 Ni 7.02058023 8.82403012 1.77070686 28 0.49621161 -0.57605128 0.02047847 Al 10.56806175 7.07912122 0.00774016 13 -0.04851694 -0.35234053 -0.55389530 H 12.33980809 8.78914397 -0.00656315 1 -0.20826689 0.16555370 -0.41566540 H 12.38141066 7.02904229 1.79451439 1 -0.30348316 -0.45175810 -0.57556659 Al 10.58929194 8.78443445 1.75556115 13 0.60001304 1.50111589 -0.70266316 Al 14.10907614 7.00672907 0.03222758 13 0.53067648 -0.22316400 -0.84586938 Ni 15.84088791 8.78679790 0.02916555 28 0.46190309 0.26762081 0.20424205 Ni 15.85670799 7.05453283 1.76780532 28 0.58807104 -1.15159942 -0.36792263 Al 14.08674127 8.77583285 1.79307332 13 -0.66552867 1.21120587 -1.38000256 Ni 17.63154687 7.07631920 0.01129509 28 0.08231282 -0.73128789 1.00202718 Al 19.36917624 8.76227967 0.02296350 13 -1.25522859 0.12605176 1.18475905 H 19.35787065 7.05196563 1.74206280 1 -0.21201869 -0.01158371 -1.17037328 Ni 17.63890229 8.77482302 1.75022353 28 0.87491816 0.24548253 -0.29529184 Ni 0.02550423 10.53994266 0.00088057 28 1.48704605 0.28342017 1.71628975 Ni 1.77370017 12.30979526 0.02539331 28 -0.60127228 0.11140263 1.37109787 H 1.75624761 10.54441620 1.78637100 1 -0.96520048 0.73844898 -1.01859104 Ni -0.00763712 12.34724883 1.78360630 28 1.41812339 0.19597223 -0.49565405 Al 3.52694306 10.56432881 -0.00571274 13 -0.44975821 1.32878393 -1.05029045 H 5.25359512 12.32134881 0.01620630 1 0.18317421 0.25892061 0.00989792 Ni 5.27927617 10.56003736 1.76146408 28 0.68537215 1.12394535 0.00593590 Ni 3.55148658 12.29703323 1.73438868 28 -0.63577167 0.30984377 0.56195943 Al 7.06890645 10.58421124 -0.00113974 13 -0.15156688 0.11840535 -0.45095516 Al 8.80161604 12.35271082 -0.03318052 13 0.28684956 0.69719091 0.60159448 Ni 8.78416208 10.59166562 1.75640079 28 0.39143864 0.52298538 -0.00760245 H 7.01396683 12.33809426 1.77746177 1 0.33704766 0.12209221 -0.76493630 H 10.54651756 10.56074907 0.01030789 1 -0.09877448 0.15092307 -0.12734245 Ni 12.36913529 12.32009945 -0.02759626 28 -0.17385687 -0.48970884 0.89120358 Ni 12.32901697 10.61012378 1.75780183 28 0.50543164 -0.20134080 -0.11196269 Al 10.58943279 12.33220954 1.77747808 13 -0.81789870 -0.55082662 0.19482700 H 14.06849267 10.53523133 -0.01283211 1 -0.34898631 0.37565887 -0.13358615 H 15.84406947 12.28836415 0.02555988 1 0.25820013 0.16703512 -0.21081971 Al 15.85803120 10.54429807 1.76236435 13 -0.16084814 0.79237850 -2.12633715 Ni 14.11831284 12.33350409 1.72847488 28 -0.37104476 -0.34549349 0.47069563 H 17.59330173 10.60452508 -0.01666102 1 0.65857060 -0.09806115 -0.12787172 Ni 19.40679939 12.34003020 -0.01899920 28 -1.35934587 -0.17220292 1.51156022 H 19.38799248 10.57902088 1.78302465 1 0.16874234 0.36428995 -0.67130419 Ni 17.63862571 12.35278832 1.75829884 28 0.42528719 -0.64352651 -0.90918943 Ni -0.02452140 14.05820572 -0.01927392 28 1.34808796 -0.37861466 1.24850339 Ni 1.72200217 15.86974569 0.00988610 28 0.30760139 0.11283983 1.63101214 H 1.74083346 14.05376015 1.79455166 1 -0.57322419 -0.18298642 -0.33063900 Al 0.00652765 15.86567565 1.77705901 13 0.15908135 -0.45105569 -0.12526148 Al 3.55056478 14.02893898 0.01738491 13 -1.71262263 -0.12723027 -0.99607636 Al 5.30858966 15.82038280 0.02158547 13 0.71726664 1.70032439 0.30601682 Al 5.27190444 14.07818829 1.76188242 13 0.46550246 -0.66414738 0.77964270 Ni 3.49513937 15.84877049 1.75097367 28 -0.61334875 0.35170240 0.09926002 Ni 7.05459246 14.08405931 -0.00268007 28 0.25953334 -0.17525498 1.53122040 Ni 8.80320436 15.86888118 0.01501213 28 -0.07690845 -0.58143885 1.79400327 H 8.78918145 14.07807440 1.76200612 1 -0.39495627 0.52129623 -0.83518915 H 7.02285216 15.87574102 1.74389143 1 0.54273009 0.01376588 -0.81290452 H 10.56203823 14.10197961 -0.00160274 1 -0.62574373 -0.00339933 -0.45253363 Al 12.31450517 15.86111624 -0.01893509 13 -0.91812150 -0.08434109 -0.90083703 Al 12.27241867 14.11594318 1.75514156 13 0.23236262 -0.48357946 0.35590032 H 10.58776981 15.83659148 1.74454537 1 -0.84673915 0.56478268 -0.66823327 Al 14.11965568 14.09409864 -0.02478719 13 0.55220032 -0.59532573 -1.35246556 H 15.84177813 15.86172590 0.00838877 1 0.39425056 0.28264995 0.00434744 Al 15.85389929 14.07980088 1.76685089 13 0.54972958 1.04458991 -0.69391357 Ni 14.14528595 15.81927246 1.76412796 28 -0.04951618 0.24476273 0.42572977 Ni 17.64145149 14.08046335 0.01552754 28 -0.09545527 0.49168297 1.03091678 Ni 19.40671443 15.84355548 -0.02766313 28 -1.59234566 -0.09873287 1.69933121 Ni 19.36173638 14.10682729 1.73645787 28 -0.48270422 0.45892509 -0.11135195 H 17.58501617 15.83341662 1.77263497 1 1.03523958 0.11450111 -0.65321401 H 0.01645098 17.59672023 -0.00778884 1 0.32036504 -0.12762793 0.16810246 H 1.75722900 19.36859811 0.00693308 1 0.05385177 0.03977288 0.42398243 H 1.79804937 17.63322013 1.79739949 1 -0.21316258 -0.08942434 -0.06064158 Al 0.03228877 19.40340219 1.76093446 13 0.61324708 -1.40628456 -0.23680672 H 3.51759020 17.60744306 0.04779838 1 0.28774362 0.11195878 0.22945712 Ni 5.29369160 19.35071132 -0.03273237 28 0.00539986 -1.87426756 1.94603522 H 5.27546162 17.64553353 1.73221251 1 0.11831694 0.92841792 -0.83897491 Al 3.49856621 19.38263534 1.73582044 13 0.67895366 -1.14879525 -1.19984599 H 7.09495737 17.62377059 -0.00726788 1 -0.21691124 0.32292559 0.27232435 H 8.83246452 19.32182108 -0.02155490 1 -0.37691710 -0.11007593 0.29770573 Al 8.81043513 17.58172262 1.74011516 13 -1.35857841 -0.00348347 0.09632958 Ni 7.05068511 19.39716317 1.73849546 28 -0.41935233 -2.26808202 0.03338666 Al 10.54872202 17.62320486 0.01869321 13 0.05738862 0.29832740 0.36085393 H 12.37287593 19.38221597 -0.01261580 1 -0.09926043 -0.11804230 0.08635101 Ni 12.31215036 17.58090141 1.74548476 28 -0.11658509 0.33694521 0.31293810 H 10.52338442 19.37561370 1.79086446 1 0.19160819 -0.02173702 -0.20489434 Al 14.08611927 17.61967303 0.04736121 13 0.85311456 0.94259813 -0.06759044 Ni 15.90270962 19.39195468 -0.03517996 28 -0.12275906 -1.40637130 1.55862400 Ni 15.85202475 17.62713243 1.71074533 28 0.38559304 -0.38390865 0.10272523 H 14.09828952 19.34255675 1.75473307 1 0.47948509 -0.22054689 0.11777656 H 17.64119674 17.60428042 0.04379080 1 0.19018307 -0.04307219 0.25471461 H 19.38260776 19.35173394 -0.02728044 1 0.00436200 -0.32657661 0.23135763 Ni 19.33975170 17.63149598 1.76582111 28 -0.77535847 -0.92859662 -0.63663994 Al 17.64845889 19.35132571 1.78740617 13 -0.43345310 1.12671672 -0.73088069 Al -0.00275165 0.03481691 3.49616990 13 -0.78455990 0.00741175 0.50183817 Al 1.78139432 1.75379221 3.48826721 13 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0.60815118 -0.00742440 -1.24693940 H 5.29108209 5.25575588 3.50773767 1 0.58288455 -0.37884783 -0.56329438 Al 5.28317421 3.52870059 5.24914767 13 1.53070281 -0.25394924 -1.32315880 Al 3.52729533 5.25093217 5.28672741 13 1.40905172 1.45288532 -0.78574958 Ni 7.07710639 3.54991828 3.50928280 28 -0.22449570 0.08432045 0.24132770 H 8.82966590 5.31663773 3.49952206 1 -0.57806890 -0.52391984 0.33823767 Ni 8.80735735 3.51765007 5.31765627 28 -0.31977155 0.00598363 -1.03569251 Ni 7.05363877 5.28237474 5.29438015 28 -0.33254537 0.39108744 -0.48682846 H 10.53929378 3.53182956 3.50279990 1 -0.05646883 -0.18362804 -0.72251890 H 12.33729178 5.26319610 3.50169447 1 -0.14884949 -0.44819579 -0.72076007 Al 12.36195728 3.49986326 5.26809830 13 1.17586731 -0.13583712 -1.40081760 Al 10.58380741 5.26254264 5.29797501 13 -1.52739825 0.42585084 -1.72198175 Al 14.08402236 3.53555475 3.51011063 13 -0.08598748 -0.18267296 -0.31268754 Ni 15.81638649 5.26268301 3.50923833 28 0.15219907 0.40240266 0.16552245 Ni 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