864 Lattice="19.51962728090941 0.0 0.0 0.0 19.51962728090941 0.0 0.0 0.0 19.51962728090941" Properties=species:S:1:pos:R:3:Z:I:1:forces:R:3 energy=-2144.7389601970776 pbc="F F F" Ni -0.01793672 -0.01738073 0.01923372 28 1.28026562 1.33096464 0.25968948 H 1.59516364 1.59804894 -0.02389195 1 -0.70513622 -0.67455731 0.71697330 Ni 1.60025885 0.01946398 1.64213807 28 -0.54142987 0.08997448 0.74894958 Ni -0.01418443 1.59678499 1.65879522 28 1.85517124 1.34526155 1.19242053 Ni 3.25677955 0.01287739 -0.01210763 28 -0.34976054 1.07155448 -0.26370530 H 4.83102197 1.63570126 0.02291645 1 -0.33832020 -0.18299820 0.62545632 Ni 4.85909937 -0.01805682 1.65873308 28 1.67574289 0.68535825 0.29740158 Ni 3.23243176 1.59872783 1.61639250 28 -0.75472077 1.22283117 0.08188232 H 6.49815041 -0.01645427 -0.01084124 1 -0.24910355 0.14266011 0.45965531 H 8.15902713 1.62877302 -0.02293451 1 0.60443681 0.16443586 0.07170994 H 8.11664229 0.03040913 1.62533893 1 0.56340431 0.41565065 0.05578968 Ni 6.50703801 1.65430738 1.65606950 28 0.39822039 -1.71299143 -0.60081571 Ni 9.77785741 0.00278262 -0.02646147 28 -0.35202846 2.15041197 2.76250321 Ni 11.39086980 1.60691376 -0.00224742 28 -1.29510397 0.26462656 1.32970830 H 11.39216557 0.02806279 1.63968253 1 -0.13105777 0.37364047 -0.84914011 H 9.77124909 1.67034620 1.61221167 1 0.12862228 -0.13676826 -0.57043885 Ni 12.97547030 0.01498001 0.01849427 28 -0.20780802 0.08715237 0.34452685 H 14.63875088 1.60383002 0.02544989 1 -0.53672018 -0.26761185 0.53919465 Ni 14.62492529 -0.02961110 1.62896223 28 0.66970124 -0.51322223 -1.46947912 Ni 13.03793297 1.63459880 1.62857049 28 -1.12750642 0.89120974 -0.10123589 H 16.28561197 -0.03142314 -0.02273091 1 0.42939498 0.78416252 0.34959763 Ni 17.86472800 1.56414678 -0.02540949 28 -1.73664728 -0.31548960 1.36114677 H 17.91752077 -0.01990514 1.61599555 1 -0.43421154 0.77680727 -0.27677124 Ni 16.28597232 1.62958853 1.62584309 28 0.57548700 -0.76484410 -1.53282456 Ni -0.03187974 3.24166912 -0.02485356 28 1.62727005 -1.01201956 0.78245079 Ni 1.65163718 4.91681088 -0.02285494 28 -0.91330112 0.10282019 0.68836660 H 1.63561550 3.28090863 1.65864845 1 -0.69190235 0.42126154 -0.73487709 Ni -0.03069081 4.86215054 1.61822398 28 1.48374214 0.18689581 0.83465751 Ni 3.24462073 3.23437051 0.02380970 28 -0.97464909 -1.45156519 -0.53944683 Ni 4.87852364 4.90716190 -0.01326930 28 0.73874422 0.50109150 -2.46303745 Ni 4.90842804 3.28226439 1.65138413 28 -0.66493192 -2.47643359 -0.87926097 Ni 3.25620737 4.88526167 1.65208868 28 -2.38767411 -0.39861492 -1.12533784 Ni 6.50437790 3.22757379 0.01040678 28 0.90473759 -1.34941070 -0.49426686 Ni 8.13782588 4.86160864 -0.00611542 28 0.50556690 0.55486837 0.92816214 H 8.13430302 3.27268213 1.62762601 1 -0.17268933 -0.16104682 -0.48463508 Ni 6.49595749 4.89698254 1.62918162 28 2.36988434 -0.29061211 -0.61868909 Ni 9.75301250 3.27818092 0.00185673 28 0.20772246 -0.55109924 3.03079023 H 11.39395544 4.90520163 -0.01938552 1 0.34723872 -0.48801783 -0.08652299 H 11.41198890 3.26585955 1.60216044 1 -0.15610196 -0.24241883 -0.76153032 H 9.72935796 4.86430164 1.63490972 1 -0.44659367 -0.24728413 -0.23084374 Ni 12.99534039 3.24381750 -0.02904997 28 -0.84251817 0.10215870 -0.30324242 Ni 14.63522564 4.90324617 -0.03014097 28 1.60849162 0.13947810 0.55894674 Ni 14.62598579 3.28234897 1.66950314 28 0.75384613 0.93169509 -0.43883496 Ni 13.02996931 4.91789189 1.63635249 28 -0.72486334 -0.20377745 0.32790524 H 16.28659433 3.28031223 -0.01307360 1 0.50165539 -0.43949224 0.47269048 H 17.89168618 4.91209791 -0.01291611 1 -0.25553312 0.34160965 0.65371434 Ni 17.88532089 3.27693052 1.65552158 28 -0.51276756 0.51348276 -0.83435723 H 16.27075559 4.91889725 1.63600262 1 0.73454289 0.26926670 0.00073634 H 0.02449871 6.52394545 0.03970092 1 0.21601778 -0.76423451 0.29761190 H 1.62344644 8.12439171 0.00297065 1 -0.33358139 0.38996192 -0.23439669 H 1.63584483 6.52247973 1.63741487 1 0.04053837 -0.98031177 -0.36775737 H -0.00561452 8.14443349 1.60481194 1 -0.14441105 0.66452495 -0.61192396 Ni 3.25027590 6.51682436 -0.02149434 28 -1.46364472 1.39543628 0.43974201 Ni 4.85190680 8.14138490 -0.01687176 28 0.11221950 0.67029164 1.84820020 Ni 4.88714049 6.49312809 1.63657197 28 0.78395799 2.24663329 -1.50972663 H 3.23423821 8.13577063 1.60542089 1 0.77865399 -0.43555801 -0.44212857 H 6.51393735 6.54170640 -0.00983222 1 -0.11024615 -0.12523832 0.18235078 H 8.11682822 8.11158940 0.02039952 1 -0.06214927 0.43484759 0.14063097 Ni 8.14416171 6.51735944 1.63653521 28 -0.40385750 -0.44306130 -1.64256474 H 6.50357524 8.09091884 1.66802494 1 -0.28491550 -0.12259244 -0.01120860 H 9.76345516 6.54665546 0.01504310 1 -0.27952907 0.00264279 0.14206899 Ni 11.42290056 8.12405272 0.00057916 28 -0.12302560 -0.55772920 -0.59320765 H 11.44170027 6.55187480 1.67717233 1 0.32501075 0.10561004 0.04308369 Ni 9.74677524 8.10694261 1.60315801 28 -0.28896879 -0.52481536 -1.64830754 Ni 13.00570389 6.50472366 -0.02071112 28 -0.45321916 -0.84886959 0.29723917 Ni 14.68263423 8.09541774 0.00398185 28 -0.03049658 -0.19956326 0.22364112 H 14.60327787 6.46450879 1.62789812 1 -0.09199881 0.03355424 -1.00216517 Ni 13.04069561 8.15658379 1.59717602 28 -0.25151970 -1.47918073 -1.04057316 Ni 16.23960812 6.53588239 0.02111588 28 0.51392996 -0.20301327 2.06654890 H 17.89183657 8.17071172 -0.01205338 1 -0.64385538 -0.24569066 0.20749843 Ni 17.92171502 6.47063652 1.62375859 28 -0.79698396 -0.22752053 -1.19438391 H 16.22094426 8.15536500 1.59459784 1 -0.04553910 -0.30042659 -0.53477031 Ni 0.02812589 9.74689640 -0.01879422 28 1.71325777 -1.02388517 1.81713167 Ni 1.64200126 11.33736191 -0.00999163 28 1.10873418 0.33960273 0.98971815 H 1.65770328 9.76925685 1.61790354 1 -0.70704844 1.26942961 -0.84890630 Ni -0.03124247 11.38605006 1.60443784 28 0.65782735 -0.68865944 0.61068029 H 3.27092762 9.74890780 -0.02088222 1 -0.03367457 0.18794106 0.04985286 H 4.87064655 11.40200230 0.00867154 1 0.68683557 -0.02172900 0.49945469 H 4.87905685 9.75116744 1.63509599 1 0.40887407 0.00580426 -0.49799954 Ni 3.27517488 11.38203278 1.63209287 28 -0.50847840 -1.71953379 -1.62216991 Ni 6.48252503 9.75266445 0.00583602 28 0.24518663 -0.44882373 1.88913340 Ni 8.14606087 11.40229471 0.05255790 28 0.63411937 0.69023532 0.03562092 H 8.15187785 9.76903800 1.60856709 1 -0.00861138 0.50447629 -0.77962002 Ni 6.51982104 11.40556561 1.65527594 28 1.25019756 -0.92491162 1.84480488 Ni 9.76043433 9.75764822 0.01171814 28 -1.75568814 -0.74807337 -0.98969527 Ni 11.39529936 11.40031867 -0.00866281 28 0.84776056 0.60919590 0.43562519 Ni 11.40816714 9.76939847 1.59578186 28 1.71108243 0.86183408 -0.79253020 Ni 9.74972338 11.35534744 1.63161615 28 -1.77024345 2.30057088 1.13246543 H 13.01823767 9.76558931 -0.00830231 1 -0.30534755 -0.24434017 0.09932783 H 14.66976211 11.37349466 -0.00904682 1 0.71116713 0.42466819 0.28523778 Ni 14.63170359 9.72887033 1.59654141 28 0.58920939 1.58810932 -0.94737464 H 13.03145503 11.42095811 1.63584635 1 -0.06759440 0.26199797 -0.30565643 Ni 16.27669814 9.78540244 0.00385750 28 0.55317088 -1.03018005 0.37698952 Ni 17.89080080 11.37097738 -0.00350615 28 0.55468293 0.36188267 1.14456053 H 17.91871539 9.74923480 1.66156380 1 -0.45485814 0.97094322 0.13188702 Ni 16.28484121 11.37183445 1.60411996 28 -0.00347772 0.59396715 1.18755601 Ni -0.02587491 12.98020763 0.01361527 28 0.50799981 -0.09414433 0.46431403 Ni 1.61367482 14.64042695 0.01157639 28 0.99201144 -1.51004027 0.69075752 H 1.59986101 13.01057223 1.61644535 1 -1.10331777 -0.54846330 -0.40750670 Ni 0.00221170 14.66057317 1.65431279 28 -1.10720375 -0.69369126 -1.05149709 H 3.25593650 13.06439966 0.00942183 1 -0.26741323 0.06583092 0.15538268 Ni 4.90523398 14.65514071 0.01449366 28 -1.86561135 0.75957305 -0.21161450 Ni 4.86837942 13.01954540 1.57840803 28 -1.01717775 0.74597558 0.38634812 H 3.23063655 14.67210716 1.62066320 1 -0.21997957 0.58936412 -0.65385371 Ni 6.51714551 12.99282512 0.02209938 28 0.40567393 -0.62307714 -1.14795708 Ni 8.15882242 14.65034423 0.00498662 28 1.73503646 -0.01177029 1.67666359 H 8.11207825 13.03996385 1.60312456 1 -0.63619313 0.20893137 -0.76765033 Ni 6.47715345 14.64924527 1.59737232 28 0.52642347 0.38218381 2.20499137 H 9.70177378 13.00941345 0.03001866 1 -0.41743006 -0.45640492 -0.04051579 H 11.35576180 14.64938028 0.00171005 1 0.83126625 -0.08117550 -0.17648046 H 11.41729626 13.00889623 1.64704047 1 0.35435905 -0.67697137 -0.77360834 H 9.78552799 14.61692401 1.62538829 1 -0.82438212 0.21608890 -0.08675378 Ni 13.03654246 13.01920722 0.02714862 28 0.33341121 -0.32180276 3.06671100 Ni 14.61123059 14.63742762 0.01748375 28 0.50676187 -0.75682214 0.85926863 H 14.64171356 13.03899418 1.60139738 1 0.19002694 -0.23189459 -1.10100357 H 12.98536086 14.63168816 1.63314371 1 0.61299115 0.06258723 -1.34240092 Ni 16.27258232 12.97748106 -0.00055609 28 -1.07522390 0.39609963 1.12631776 Ni 17.86735806 14.62881526 0.00310382 28 -1.22672586 -0.41808707 2.40498196 H 17.87337231 13.01954650 1.59814631 1 -0.52142867 -0.73742138 -0.93859363 H 16.25359954 14.61222730 1.62344337 1 0.09851776 0.50868784 -1.42010109 H 0.03142125 16.26444156 -0.02787936 1 0.38436895 -0.17548804 0.80624183 H 1.62409829 17.88439330 -0.00834742 1 0.24123170 -0.35706433 0.92206138 Ni 1.58691741 16.25174516 1.61388197 28 0.45049948 1.55085373 -0.86659473 Ni -0.01351133 17.92312144 1.61178398 28 1.60568604 -0.94954772 -0.11915731 Ni 3.22387005 16.24734076 -0.01909725 28 0.41652123 -0.12861105 0.56668755 Ni 4.85196926 17.86486261 0.02759202 28 1.10427958 -0.71946798 1.06079253 H 4.85062698 16.25487366 1.63506475 1 0.06412879 0.45121827 -0.83161335 Ni 3.26353151 17.86875771 1.63664765 28 -0.17313131 -0.19020040 0.87114332 Ni 6.52969132 16.29619196 -0.01575360 28 -0.08161505 0.55359309 1.08493088 Ni 8.09670936 17.88818162 0.02626211 28 -0.00400773 -1.77985945 2.12734363 H 8.11707407 16.29609888 1.62876351 1 -0.36829797 0.34692851 -0.57125413 H 6.49503634 17.88341143 1.60080124 1 0.31627914 -0.65374257 -1.05103013 H 9.76240230 16.24813111 -0.01990791 1 -0.99682962 0.74745841 0.47428013 H 11.35778301 17.87325045 0.02030808 1 0.00241809 -0.22811261 1.00414448 H 11.39247501 16.26394014 1.64305294 1 0.05177403 1.10478396 -0.43786784 Ni 9.79075408 17.89151835 1.62722729 28 0.70353624 -3.54690409 0.63646799 Ni 13.00846899 16.29058582 -0.01185672 28 -1.78398674 -0.88815248 0.30174243 Ni 14.66361544 17.89913012 0.00729954 28 0.78778415 0.40071117 0.26602939 Ni 14.62721407 16.26766399 1.62186518 28 0.17981887 -1.36255839 1.49186768 Ni 12.99845580 17.89432837 1.60973721 28 -2.17475692 -0.46069442 1.13937987 Ni 16.27097570 16.24268206 -0.02014202 28 0.95097371 0.30672752 1.31162579 H 17.87658236 17.88735781 -0.00817814 1 -0.39220334 -0.47334079 0.08915774 H 17.89693929 16.30878536 1.61205858 1 -0.54620373 0.11678048 0.10684411 H 16.27266042 17.89550131 1.63340873 1 -0.22203580 -0.74190376 0.46869070 H 0.01904233 0.01693601 3.25353601 1 0.68810971 0.31449395 -0.39246198 H 1.64189955 1.60360253 3.26486300 1 0.33922747 -0.74366141 0.07579236 Ni 1.60042028 -0.01346388 4.86981709 28 -0.16403236 1.94213212 -0.14609691 H -0.01172271 1.63922335 4.85623272 1 0.57966933 -0.71643808 0.62938475 Ni 3.28432610 -0.00980456 3.22464537 28 -0.43372823 0.24541299 0.59143623 H 4.88154973 1.60326750 3.29666128 1 -0.30296466 -0.86684492 -0.07581048 Ni 4.90901435 -0.02448078 4.85364099 28 1.49504286 2.25256185 0.37323366 Ni 3.25699873 1.64193885 4.90733878 28 0.92594842 -0.73112175 0.74377248 H 6.46130528 0.00493573 3.26611926 1 -0.20820041 0.30105298 0.29703802 Ni 8.12640171 1.62003402 3.24129074 28 -0.71969723 0.05981881 -1.05357182 Ni 8.12869189 -0.02074892 4.84770066 28 -1.98256697 0.76473043 1.45115193 H 6.51665072 1.64472722 4.86026381 1 0.21629620 -0.26898923 -0.05192382 Ni 9.74000797 -0.01422898 3.27513159 28 0.35298094 -0.80474746 -2.89232967 Ni 11.37494391 1.61903494 3.24421721 28 0.01317439 0.89411250 -3.24745978 Ni 11.40219657 0.02292772 4.86116585 28 -1.06768298 -1.21316865 1.96539936 Ni 9.73821769 1.60012660 4.85444868 28 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4.84786957 3.23494056 28 0.06342628 0.39207314 4.10298211 H 4.84524883 3.23991488 4.88623052 1 -0.04294076 -0.36112790 0.35902525 H 3.27529237 4.85704074 4.84256524 1 -0.97155312 -0.19992244 0.10296477 Ni 6.50737884 3.25743990 3.24189484 28 1.15972334 -0.15439200 2.63149888 H 8.12976846 4.87453276 3.25805716 1 0.04008796 0.17676354 -0.42856474 H 8.12555609 3.23208372 4.89017330 1 -0.25365755 -0.55277056 -0.38077331 H 6.54192139 4.89954022 4.89190281 1 -0.04186260 -0.13977855 0.24998510 Ni 9.75897660 3.23221467 3.28495082 28 -2.00783364 1.88333492 -2.44547287 Ni 11.39924600 4.88134687 3.25227343 28 -1.25302618 -0.48197396 -1.20934585 Ni 11.35912932 3.21285447 4.89722373 28 -0.60981529 0.12380770 0.80547292 H 9.73795700 4.87754690 4.90705704 1 0.34336135 -0.06085806 -0.59576518 H 13.03735972 3.21002652 3.19671501 1 -0.07942856 -0.07337462 -0.25168664 H 14.67643732 4.87838400 3.23163559 1 0.18640597 -0.04520086 -0.34753480 H 14.61342993 3.23362513 4.87106143 1 0.04169564 -0.05840935 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