#BaF
0.00000000000000 0.00000000000000 -2.07069892703602 ba
0.00000000000000 0.00000000000000 2.07069892703602 f
#BaF2
0.00000000000000 0.00000000000000 1.55847796152849 ba
3.50406263138391 0.00000000000000 -0.77923898076424 f
-3.50406263138391 0.00000000000000 -0.77923898076424 f
#BaH2
0.00000000000000 0.00000000000000 1.68536306424487 ba
3.48553102731125 0.00000000000000 -0.84268153212243 h
-3.48553102731125 0.00000000000000 -0.84268153212243 h
#BaO
0.00000000000000 0.00000000000000 -1.92962468481039 ba
0.00000000000000 0.00000000000000 1.92962468481039 o
#BaS
0.00000000000000 0.00000000000000 -2.42999531404145 ba
0.00000000000000 0.00000000000000 2.42999531404145 s
#Be2F4
-2.13361594547065 0.00000000000000 0.00000000000000 be
2.13361594547065 0.00000000000000 0.00000000000000 be
0.00000000000000 2.13211302712278 0.00000000000000 f
0.00000000000000 -2.13211302712278 0.00000000000000 f
-4.78939030299712 0.00000000000000 0.00000000000000 f
4.78939030299712 0.00000000000000 0.00000000000000 f
#Be2H4
0.00000000000000 0.00000000000000 -1.92929449970282 be
0.00000000000000 0.00000000000000 1.92931071700141 be
2.05284948165387 0.00000000000000 -0.00000554462538 h
-2.05284948165387 0.00000000000000 -0.00000554462538 h
0.00000000000000 0.00000000000000 -4.46632923721534 h
0.00000000000000 0.00000000000000 4.46632410916751 h
#Be4
1.98239336244068 -1.40175406475758 0.00000000000000 be
-1.98240276048822 -1.40176820517744 0.00000000000000 be
0.00000469902377 1.40176113496751 -1.98238088228083 be
0.00000469902377 1.40176113496751 1.98238088228083 be
#BeC2H6
0.00000000000000 0.00000000000000 0.00000000000000 be
-0.00020044556495 3.18689981828802 0.00000000000000 c
0.00020044556495 -3.18689981828802 0.00000000000000 c
1.94277443489397 3.99483630431448 0.00000000000000 h
0.97131508976867 -3.99480784611534 -1.68303202724579 h
-0.97131508976866 3.99480784611534 -1.68303202724579 h
-1.94277443489397 -3.99483630431448 0.00000000000000 h
-0.97131508976866 3.99480784611534 1.68303202724579 h
0.97131508976867 -3.99480784611534 1.68303202724579 h
#BeF2O2H4
-0.00000032363640 -0.00000008566633 -0.88438717282531 be
0.00000013544101 -2.55923932656878 -2.01794116529110 f
-0.00000415512240 2.55924102532360 -2.01793952586888 f
2.70021194774609 -0.00000008523155 1.18317601953195 o
-2.70021065005859 0.00000715003053 1.18318161817594 o
3.67189018000387 1.47880857364976 0.63847717253928 h
-3.67189013209522 -1.47881214872542 0.63847438690258 h
3.67189002508221 -1.47880764617565 0.63847412415729 h
-3.67188702736059 1.47880254336382 0.63848454267826 h
#BeH2
0.00000000000000 0.00000000000000 0.00000000000000 be
0.00000000000000 0.00000000000000 2.54057183216976 h
0.00000000000000 0.00000000000000 -2.54057183216976 h
#BeS
0.00000000000000 0.00000000000000 -1.67244267945864 be
0.00000000000000 0.00000000000000 1.67244267945864 s
#CaCl2
0.00000000000000 0.00000000000000 0.00000000000000 ca
0.00000000000000 0.00000000000000 -4.87191849109726 cl
0.00000000000000 0.00000000000000 4.87191849109726 cl
#CaF2
0.00000000000000 0.00000000000000 0.00000000000000 ca
0.00000000000000 0.00000000000000 -3.97143043764854 f
0.00000000000000 0.00000000000000 3.97143043764854 f
#CaH2
0.00000000000000 0.00000000000000 0.00000000000000 ca
0.00000000000000 0.00000000000000 4.04362377931292 h
0.00000000000000 0.00000000000000 -4.04362377931292 h
#CsF
0.00000000000000 0.00000000000000 -2.43002010389848 f
0.00000000000000 0.00000000000000 2.43002010389848 cs
#CsH
0.00000000000000 0.00000000000000 -2.51401278411792 cs
0.00000000000000 0.00000000000000 2.51401278411792 h
#CsO
0.00000000000000 0.00000000000000 -2.61735090985010 o
0.00000000000000 0.00000000000000 2.61735090985010 cs
#K2S
0.00000000000000 0.00000000000000 1.75493373992356 s
-4.68812462132366 0.00000000000000 -0.87746686996178 k
4.68812462132366 0.00000000000000 -0.87746686996178 k
#K3P
0.00000000000000 0.00000000000000 1.89749417626207 p
2.58580346543032 -4.47874298051299 -0.63249805875402 k
2.58580346543032 4.47874298051299 -0.63249805875402 k
-5.17160693086064 0.00000000000000 -0.63249805875402 k
#KBr
0.00000000000000 0.00000000000000 -2.75588742538509 k
0.00000000000000 0.00000000000000 2.75588742538509 br
#KCl
0.00000000000000 0.00000000000000 -2.59307106746649 k
0.00000000000000 0.00000000000000 2.59307106746649 cl
#KF
0.00000000000000 0.00000000000000 -2.13462007168556 k
0.00000000000000 0.00000000000000 2.13462007168556 f
#KH
0.00000000000000 0.00000000000000 -2.20252950247800 k
0.00000000000000 0.00000000000000 2.20252950247800 h
#KI
0.00000000000000 0.00000000000000 -3.00693295045154 k
0.00000000000000 0.00000000000000 3.00693295045154 i
#Li2
0.00000000000000 0.00000000000000 2.64099487417752 li
0.00000000000000 0.00000000000000 -2.64099487417752 li
#Li2O
0.00000000000000 0.00000000000000 0.00000000000000 o
0.00000000000000 0.00000000000000 3.07886917104883 li
0.00000000000000 0.00000000000000 -3.07886917104883 li
#Li4C4H12
1.64706365185023 -1.64706414193258 1.64706544369022 li
-1.64706403016091 1.64706609392631 1.64705887225055 li
-1.64706511498339 -1.64706283357271 -1.64706684500640 li
1.64706611886332 1.64706488898669 -1.64706698536379 li
-2.43039744530168 -2.43039421024393 2.43039371335858 c
-2.43039481981438 2.43039861558535 -2.43039404610143 c
2.43041016795889 -2.43037962486503 -2.43040830076453 c
2.43039584881608 2.43039712925517 2.43039442430495 c
-3.75314966263209 -3.75314808906104 1.42781762772074 h
-3.75315152314663 1.42782582005728 -3.75315082553213 h
3.75314761464945 -3.75315658904388 -1.42781372983920 h
3.75314887684819 1.42782119712603 3.75314726754457 h
3.75315353972696 -1.42784583286734 -3.75312947798914 h
-1.42781763382581 3.75315092168214 -3.75315637933721 h
-1.42782024327477 -3.75314815761710 3.75314688009472 h
3.75314899897099 3.75315138842044 1.42781694923781 h
1.42781612597795 -3.75315104845671 -3.75315272040008 h
-3.75315006597704 -1.42781843578250 3.75314714040825 h
1.42782002306320 3.75315047748770 3.75314651403628 h
-3.75316042760865 3.75314243091576 -1.42779552231280 h
#Li4Cl4
2.74433107302748 -1.94051594179951 0.00000000000000 li
0.00000067632057 1.94051446095008 2.74434044508148 li
-2.74434673087586 -1.94050438549579 0.00000000000000 li
0.00000067632057 1.94051446095008 -2.74434044508148 li
3.45559531815124 2.44348827432849 0.00000000000000 cl
-0.00000377172669 -2.44349841628354 3.45558889743391 cl
-3.45557361860438 2.44349993543522 0.00000000000000 cl
-0.00000377172669 -2.44349841628354 -3.45558889743391 cl
#Li4H4
1.70080534683096 1.70080537092335 1.70080629791783 li
-1.70080500921405 1.70080539807377 -1.70080575731674 li
-1.70080602667080 -1.70080602949547 1.70080562105870 li
1.70080538482293 -1.70080498514297 -1.70080576838347 li
-1.85949824812399 1.85949816528516 1.85949815526986 h
-1.85949848558192 -1.85949846568449 -1.85949840131317 h
1.85949821284325 -1.85949826186725 1.85949814331282 h
1.85949882509361 1.85949880790790 -1.85949829054584 h
#Li8
2.74131108923626 2.74132478269676 2.74117649987501 li
-2.74132095967384 2.74139733087893 2.74123662814823 li
-2.74141505700265 -2.74140311587089 2.74132801066027 li
2.74142424897969 -2.74136699425814 2.74128552508306 li
2.74120592621730 -2.74115999255214 -2.74129238641303 li
2.74113282151043 2.74114762466293 -2.74121705828456 li
-2.74113063835797 2.74118015543297 -2.74125140645887 li
-2.74120743090921 -2.74111979099044 -2.74126581261013 li
#LiBH4
-0.00024869116689 -0.69457330488353 0.00000000000000 b
0.00086758333408 -2.99344227721830 0.00000000000000 h
1.10203755028072 0.22558430838791 -1.90940541026977 h
1.10203755028072 0.22558430838791 1.90940541026977 h
-2.20471760670618 0.22450989127912 0.00000000000000 h
0.00002361397754 3.01233707404689 0.00000000000000 li
#LiCl
0.00000000000000 0.00000000000000 -1.93849439881658 li
0.00000000000000 0.00000000000000 1.93849439881658 cl
#LiF
0.00000000000000 0.00000000000000 -1.48697136026104 li
0.00000000000000 0.00000000000000 1.48697136026103 f
#LiH
0.00000000000000 0.00000000000000 1.54697769798700 li
0.00000000000000 0.00000000000000 -1.54697769798700 h
#LiSLi
0.00000000000000 0.00000000000000 0.00000000000000 s
0.00000000000000 0.00000000000000 3.94716240337943 li
0.00000000000000 0.00000000000000 -3.94716240337943 li
#Mg4
2.14509045506480 -2.14509045506480 2.14509045506480 mg
-2.14509045506480 2.14509045506480 2.14509045506480 mg
-2.14509045506480 -2.14509045506480 -2.14509045506480 mg
2.14509045506480 2.14509045506480 -2.14509045506480 mg
#MgCl2
0.00000000000000 0.00000000000000 0.00000000000000 mg
0.00000000000000 0.00000000000000 4.14223402210192 cl
0.00000000000000 0.00000000000000 -4.14223402210192 cl
#MgF
0.00000000000000 0.00000000000000 -1.67915451808357 mg
0.00000000000000 0.00000000000000 1.67915451808357 f
#MgF2
0.00000000000000 0.00000000000000 0.00000000000000 mg
0.00000000000000 0.00000000000000 3.32239429304949 f
0.00000000000000 0.00000000000000 -3.32239429304949 f
#MgH2
0.00000000000000 0.00000000000000 0.00000000000000 mg
0.00000000000000 0.00000000000000 3.23157098894782 h
0.00000000000000 0.00000000000000 -3.23157098894782 h
#Na2O
0.00000000000000 0.00000000000000 -0.00125987003817 o
3.76616708679694 0.00000000000000 0.00062993501909 na
-3.76616708679694 0.00000000000000 0.00062993501909 na
#Na2S
0.00000000000000 0.00000000000000 0.00000000000000 s
0.00000000000000 0.00000000000000 -4.54664766104049 na
0.00000000000000 0.00000000000000 4.54664766104049 na
#Na3N
0.00000000000000 0.00000000000000 0.98846813029527 n
-1.94602685234149 3.37061738114880 -0.32948937676509 na
-1.94602685234149 -3.37061738114880 -0.32948937676509 na
3.89205370468299 0.00000000000000 -0.32948937676509 na
#Na3P
0.02166950952763 -0.00927750719924 1.85753834100637 p
1.53863108521887 -3.99579517958087 -0.62708109943298 na
2.65769485647032 3.35118326979984 -0.62224016723425 na
-4.21799545121683 0.65388941698028 -0.60821707433915 na
#NaCl
0.00000000000000 0.00000000000000 -2.23125548600731 na
0.00000000000000 0.00000000000000 2.23125548600731 cl
#NaF
0.00000000000000 0.00000000000000 -1.81647944104883 na
0.00000000000000 0.00000000000000 1.81647944104883 f
#NaH
0.00000000000000 0.00000000000000 -1.79420308214526 na
0.00000000000000 0.00000000000000 1.79420308214526 h
#PLi3
-0.00040508715227 1.96231380420593 0.00000000000000 p
3.47020495828402 -0.65597305055359 0.00000000000000 li
-1.73489993556587 -0.65317037682617 3.00666083679482 li
-1.73489993556587 -0.65317037682617 -3.00666083679482 li
#RbF
0.00000000000000 0.00000000000000 -2.29684487633273 f
0.00000000000000 0.00000000000000 2.29684487633273 rb
#RbH
0.00000000000000 0.00000000000000 -2.33735012066011 rb
0.00000000000000 0.00000000000000 2.33735012066011 h
#RbO
0.00000000000000 0.00000000000000 -2.46235472688576 o
0.00000000000000 0.00000000000000 2.46235472688576 rb
#SrF
0.00000000000000 0.00000000000000 -1.95487637299250 sr
0.00000000000000 0.00000000000000 1.95487637299250 f
#SrF2
0.00000000000000 0.00000000000000 1.21686253050211 sr
3.54167198526231 0.00000000000000 -0.60843126525105 f
-3.54167198526231 0.00000000000000 -0.60843126525105 f
#SrH2
0.00000000000000 0.00000000000000 1.36780798604125 sr
-3.52443250853761 0.00000000000000 -0.68390399302062 h
3.52443250853761 0.00000000000000 -0.68390399302062 h
#SrO
0.00000000000000 0.00000000000000 -1.83598401421036 sr
0.00000000000000 0.00000000000000 1.83598401421036 o
#SrS
0.00000000000000 0.00000000000000 -2.31673677279564 sr
0.00000000000000 0.00000000000000 2.31673677279564 s
#B2H6
0.00000000000000 0.00000000000000 1.68149280660034 b
0.00000000000000 0.00000000000000 -1.68149280660034 b
0.00000000000000 -1.88412562931544 0.00000000000000 h
0.00000000000000 1.88412562931544 0.00000000000000 h
1.99832414844106 0.00000000000000 2.79335654905377 h
-1.99832414844106 0.00000000000000 2.79335654905377 h
-1.99832414844106 0.00000000000000 -2.79335654905377 h
1.99832414844106 0.00000000000000 -2.79335654905377 h
#B3N3H6
2.75503008971104 -0.00000323939483 0.00000000000000 b
1.33708167162979 2.31531468226869 0.00000000000000 n
-1.37762869492974 2.38537342180479 0.00000000000000 b
-2.67435276602476 0.00000211824938 0.00000000000000 n
-1.37764337777651 -2.38537456910514 0.00000000000000 b
1.33706851342589 -2.31531512981732 0.00000000000000 n
5.05300245977585 -0.00000804976266 0.00000000000000 h
2.30183999853162 3.98629277576524 0.00000000000000 h
-2.52609075956054 4.37610354836293 0.00000000000000 h
-4.60403920406282 0.00000416958359 0.00000000000000 h
-2.52610296250991 -4.37610284086748 0.00000000000000 h
2.30183503179008 -3.98628688708722 0.00000000000000 h
#B4H4
1.13513007545606 1.13512970003633 1.13512888659479 b
-1.13512170839976 1.13512235099020 -1.13512294487928 b
-1.13512831829025 -1.13512872380334 1.13512812346088 b
1.13513271243326 -1.13513209595804 -1.13513301541142 b
2.45171101991862 2.45170873428443 2.45170917853944 h
-2.45171753891449 2.45171830786967 -2.45171888582538 h
-2.45170898165818 -2.45171133452650 2.45171018828927 h
2.45170273945477 -2.45170693889277 -2.45170153076831 h
#BF3
0.00057162011753 0.00000112131525 0.00000000000000 b
2.50269790165942 0.00000463627076 0.00000000000000 f
-1.25162960237501 2.16558024460409 0.00000000000000 f
-1.25163991940193 -2.16558600219009 0.00000000000000 f
#BH3
0.00000000000000 0.00000000000000 -0.00001716605107 b
0.00000000000000 0.00000000000000 2.29252379962527 h
1.98536152775083 0.00000000000000 -1.14625331603055 h
-1.98536152775083 0.00000000000000 -1.14625331603055 h
#BH3CO
-0.00003267004886 1.01111329216265 0.00000000000000 b
2.24066059731720 1.62213805210289 0.00000000000000 h
-1.12023754948246 1.62311914581523 1.94044267338909 h
-1.12023754948246 1.62311914581523 -1.94044267338909 h
-0.00018198607045 -1.85414688329676 0.00000000000000 c
0.00002915776702 -4.02534275259922 0.00000000000000 o
#BH3NH3
-0.00005391609667 -0.00000006055366 1.59755328544083 b
0.00003677556503 -0.00000004984535 -1.51922811870669 n
-1.12198704238829 1.94345823821240 2.21019712023369 h
-1.81066670598354 -0.00000007552669 -2.23620407950898 h
-1.12200568324154 -1.94345788468772 2.21023739863948 h
0.90537147089552 -1.56819423165877 -2.23633381411281 h
2.24393364900982 -0.00000003812768 2.21011203996588 h
0.90537145223968 1.56819410218746 -2.23633383195137 h
#C2H2
0.00000000000000 0.00000000000000 1.15246217269357 c
0.00000000000000 0.00000000000000 -1.15237758930046 c
0.00000000000000 0.00000000000000 3.19592252631204 h
0.00000000000000 0.00000000000000 -3.19600710970514 h
#C2H3N
1.88736354706722 -0.38569072500046 0.00000000000000 n
-0.71824807664584 -0.19471094953120 -1.22023694426924 c
-0.71824807664584 -0.19471094953120 1.22023694426924 c
2.62906670020725 1.44277863614961 0.00000000000000 h
-1.53996704699139 -0.33383300604337 -3.10934257471802 h
-1.53996704699139 -0.33383300604337 3.10934257471802 h
#C2H4
-0.00000595240645 -1.26733455985489 0.00000000000000 c
-0.00001103692376 1.26733990808114 0.00000000000000 c
1.77139591530185 -2.36353680346697 0.00000000000000 h
-1.77135302848125 -2.36354228611354 0.00000000000000 h
1.77143988920888 2.36354006871598 0.00000000000000 h
-1.77146578669927 2.36353367263826 0.00000000000000 h
#C2H6
-0.00004769714133 0.00000349348608 1.44636083928208 c
0.00000804691144 0.00000483284596 -1.44638600827020 c
0.00000507341384 1.94903094277111 2.21977150357274 h
-1.68811904618790 0.97442869763498 -2.21944595476968 h
-1.68812247614916 -0.97443046693153 2.21943006405761 h
0.00000720306362 -1.94903334377391 -2.21978760781604 h
1.68813497191566 -0.97443316442446 2.21950311354087 h
1.68813392417380 0.97442900839179 -2.21944594959735 h
#C4H4
0.99384594007199 0.99384464702096 0.99383622488147 c
-0.99383778119390 0.99384857359297 -0.99384786547507 c
-0.99383837692231 -0.99383758446481 0.99383909184982 c
0.99384393287549 -0.99383406319256 -0.99384192088452 c
2.18053060627208 2.18052818251503 2.18055255481919 h
-2.18053790501712 2.18055083059018 -2.18055040079725 h
-2.18053792505281 -2.18054059788475 2.18054096602118 h
2.18053150896658 -2.18055998817700 -2.18052865041484 h
#C6H6
2.65617581771435 -0.00001755566762 0.00000000000000 c
1.32809320450038 2.30036580039517 0.00000000000000 c
-1.32814289699474 2.30032454944275 0.00000000000000 c
-2.65616474222357 -0.00002947176151 0.00000000000000 c
-1.32814664832257 -2.30031670879657 0.00000000000000 c
1.32804572900546 -2.30030596170580 0.00000000000000 c
4.73697603254869 -0.00001003497658 0.00000000000000 h
2.36858554692983 4.10225225927773 0.00000000000000 h
-2.36858598921966 4.10217914017551 0.00000000000000 h
-4.73684964271648 -0.00000987434447 0.00000000000000 h
-2.36856197133617 -4.10217066208403 0.00000000000000 h
2.36857556011450 -4.10226147995460 0.00000000000000 h
#CF4
0.00000072798427 -0.00000084127378 0.00000134823270 c
1.45612263947210 1.45612426874410 1.45612670863342 f
-1.45612382956586 1.45612744820956 -1.45611634123477 f
-1.45611302972194 -1.45611774949082 1.45611910063923 f
1.45611349183143 -1.45613312618904 -1.45613081627060 f
#CH2O
0.00001136906018 -0.00680178712325 0.00000000000000 c
0.00001124892632 -2.29137576741941 0.00000000000000 o
-1.79950764336418 1.14910699652609 0.00000000000000 h
1.79948502537768 1.14907055801657 0.00000000000000 h
#CH2O2
-0.00257696271985 -0.00029911539700 0.43566389538811 c
0.91809787651456 1.10119962920547 -1.77030267443462 o
-0.89638419996679 -1.09806893130047 -1.78331456460493 o
1.35822195950510 -1.13175262110298 1.56631140453024 h
-1.37735867333304 1.12892103859498 1.55164193912118 h
#CH3N
-0.51099882579378 -1.72615900810017 0.00000000000000 n
-0.28199635256966 0.67673092847568 0.00000000000000 c
1.26548359579527 -2.55925182755683 0.00000000000000 h
1.54014071938432 1.74203610207273 0.00000000000000 h
-2.01262913681617 1.86664380510858 0.00000000000000 h
#CH3OH
-0.60943318920949 0.23208453617070 0.00000000000000 c
-1.40349374228799 -0.73023655246102 -1.70457168393205 h
-1.40349374228799 -0.73023655246102 1.70457168393205 h
-1.34535487704355 2.19364844386480 0.00000000000000 h
2.05720432204887 0.37903865616194 0.00000000000000 o
2.70457122878014 -1.34429853127539 0.00000000000000 h
#CH4
0.00000365772543 -0.00000430204539 -0.00000303470922 c
1.20635474089927 1.20638206443483 1.20635809459961 h
-1.20637417661767 1.20636079380735 -1.20635435342573 h
-1.20635629114801 -1.20637256903187 1.20636439312342 h
1.20637206914099 -1.20636598716490 -1.20636509958807 h
#CO
0.00000000000000 0.00000000000000 -1.07901367410215 c
0.00000000000000 0.00000000000000 1.07901367410215 o
#CO2
0.00000000000000 0.00000000000000 0.00002806040915 c
0.00000000000000 0.00000000000000 2.21994735057408 o
0.00000000000000 0.00000000000000 -2.21997541098322 o
#F2
0.00000000000000 0.00000000000000 -1.33472243762606 f
0.00000000000000 0.00000000000000 1.33472243762606 f
#H2
0.00000000000000 0.00000000000000 0.72490772298399 h
0.00000000000000 0.00000000000000 -0.72490772298399 h
#H2CO3
-0.00000072368405 0.22080394668051 0.00000000000000 c
-0.00000085983362 2.51789433031705 0.00000000000000 o
2.06907082035747 -1.26682714026337 0.00000000000000 o
-2.06907034454166 -1.26683026979785 0.00000000000000 o
3.50618225374280 -0.10251893084200 0.00000000000000 h
-3.50618114604093 -0.10252193609435 0.00000000000000 h
#H2O
-0.00000092153086 0.77139067871094 0.00000000000000 o
1.43408493447591 -0.38569466553748 0.00000000000000 h
-1.43408401294505 -0.38569601317346 0.00000000000000 h
#H2O2
1.37391573291828 -0.11754325013582 0.47481512973650 o
-1.37391573291828 0.11754325013582 0.47481512973650 o
1.81764940640807 1.41027485517298 -0.47481512973649 h
-1.81764940640807 -1.41027485517298 -0.47481512973649 h
#HCN
0.00000000000000 0.00000000000000 -2.10459881646616 h
0.00000000000000 0.00000000000000 -0.05057148541107 c
0.00000000000000 0.00000000000000 2.15517030187723 n
#HF
0.00000000000000 0.00000000000000 0.88143111896247 h
0.00000000000000 0.00000000000000 -0.88143111896247 f
#HNC
0.00000000000000 0.00000000000000 -2.02196172790527 h
0.00000000000000 0.00000000000000 -0.10820520253614 n
0.00000000000000 0.00000000000000 2.13016693044140 c
#HNO
-1.79661507816673 0.48943320881840 0.00000000000000 o
0.47454096973458 0.69971484027459 0.00000000000000 n
1.32207410843215 -1.18914804909299 0.00000000000000 h
#HNO2
-0.00005991769124 0.00467141411420 0.00000000000000 n
0.00050822247803 -2.00908183598864 0.00000000000000 h
2.08688969332883 1.00263775985379 0.00000000000000 o
-2.08733799811562 1.00177266202064 0.00000000000000 o
#HNO3
-0.84920495946036 -0.15764648097179 0.00000000000000 n
-1.28916831029594 2.10044345874920 0.00000000000000 o
1.78029964374549 -0.83073113266367 0.00000000000000 o
-2.25079424696181 -1.94859046351144 0.00000000000000 o
2.60886787297262 0.83652461839769 0.00000000000000 h
#N2
0.00000000000000 0.00000000000000 -1.05078974035833 n
0.00000000000000 0.00000000000000 1.05078974035833 n
#N2H2
-1.17672812398851 0.92386039472759 0.00000000000000 n
1.17661864072211 0.92396010505874 0.00000000000000 n
-1.95539025873620 -0.92400022187768 0.00000000000000 h
1.95549974200260 -0.92382027790864 0.00000000000000 h
#N2H4
1.34301342554004 0.11487732805038 0.44262664845470 n
-1.34301342554004 -0.11487732805038 0.44262664845470 n
2.06079980354008 0.61078546738212 -1.30448136798935 h
-2.06079980354008 -0.61078546738212 -1.30448136798935 h
2.08747379308132 -1.63000779480150 0.86185471953465 h
-2.08747379308132 1.63000779480150 0.86185471953465 h
#N4
0.97352637877574 0.97353427649995 0.97350854749399 n
-0.97347107666161 0.97345970934768 -0.97348952076396 n
-0.97352288698680 -0.97351512802877 0.97348592757745 n
0.97346758487266 -0.97347885781885 -0.97350495430747 n
#NF3
-0.00023917863373 0.86723125260972 0.00000000000000 n
2.36152560364088 -0.29019299685791 0.00000000000000 f
-1.18064321250358 -0.28851912787590 2.04401593693485 f
-1.18064321250358 -0.28851912787590 -2.04401593693485 f
#NH3
-0.00002996273382 0.60419573896846 0.00000000000000 n
1.77459787410351 -0.20146478753319 0.00000000000000 h
-0.88728395568485 -0.20136547571764 1.53702086353764 h
-0.88728395568485 -0.20136547571764 -1.53702086353764 h
#NH4F
0.00035295142012 0.99586270905472 0.00000000000000 n
1.79756586681634 1.73917600761303 0.00000000000000 h
-0.89974980156668 1.73568143900128 1.55739131188531 h
-0.89974980156668 1.73568143900128 -1.55739131188531 h
0.00153471995548 -2.18853841134706 0.00000000000000 h
0.00004606494142 -4.01786318332326 0.00000000000000 f
#OF2
0.00000000000000 0.00000000000000 1.08966458588793 o
-2.12636045821744 0.00000000000000 -0.54483229294396 f
2.12636045821744 0.00000000000000 -0.54483229294396 f
#Al2O3
0.00000000000000 0.00000000000000 0.00000000000000 o
0.00000000000000 0.00000000000000 -3.20592451951933 al
0.00000000000000 0.00000000000000 3.20592451951933 al
0.00000000000000 0.00000000000000 -6.26442328261665 o
0.00000000000000 0.00000000000000 6.26442328261665 o
#Al2S3
0.00000000000000 0.00000000000000 3.16034259123655 s
-6.05680384209421 0.00000000000000 -2.01213979070925 s
6.05680384209421 0.00000000000000 -2.01213979070925 s
-3.12156733278024 0.00000000000000 0.43196849509098 al
3.12156733278024 0.00000000000000 0.43196849509098 al
#AlCl3
0.00000000000000 0.00000000000000 0.00000000000000 al
1.98010837147193 -3.42964830388186 0.00000000000000 cl
1.98010837147193 3.42964830388186 0.00000000000000 cl
-3.96021674294387 0.00000000000000 0.00000000000000 cl
#AlF3
0.00000000000000 0.00000000000000 0.00000000000000 al
1.56643211516439 -2.71314001007231 0.00000000000000 f
1.56643211516439 2.71314001007231 0.00000000000000 f
-3.13286423032878 0.00000000000000 0.00000000000000 f
#AlH3
0.00000000000000 0.00000000000000 0.00000000000000 al
1.51111027824900 -2.61731977776682 0.00000000000000 h
1.51111027824900 2.61731977776682 0.00000000000000 h
-3.02222055649801 0.00000000000000 0.00000000000000 h
#AlN
0.00000000000000 0.00000000000000 1.70183203298110 n
0.00000000000000 0.00000000000000 -1.70183203298110 al
#CS2
0.00000000000000 0.00000000000000 -0.00042370317242 c
0.00000000000000 0.00000000000000 2.96976471283164 s
0.00000000000000 0.00000000000000 -2.96934100965921 s
#Cl2
0.00000000000000 0.00000000000000 1.94562946845339 cl
0.00000000000000 0.00000000000000 -1.94562946845339 cl
#ClF
0.00000000000000 0.00000000000000 -1.58509614282258 cl
0.00000000000000 0.00000000000000 1.58509614282258 f
#ClF3
-0.00003067860727 -0.83736782989924 0.00000000000000 cl
-3.32968626746479 -0.75728391745932 0.00000000000000 f
3.32967523209023 -0.75719934611368 0.00000000000000 f
0.00004171398183 2.35185109347225 0.00000000000000 f
#H2SO4
-0.00001618652064 0.00000532998352 0.57726346501965 s
2.40449042802622 0.00000119792204 1.95483853136064 o
-2.40446876756433 0.00000117641825 1.95482480979171 o
-0.00000130197438 2.22843215334819 -1.58826869332215 o
-0.00000131291374 -2.22844560147121 -1.58825020322016 o
-0.00000143369034 3.83405981964557 -0.65522713489551 h
-0.00000142536279 -3.83405407584636 -0.65518077473415 h
#H3PO4
0.00025271029759 0.00000002775195 0.18378624273833 p
2.75771513369481 0.00000046305733 -1.18697263987526 o
-1.38058842041890 2.38580178738371 -1.18704930153066 o
-1.38058701560059 -2.38580233754762 -1.18704935129008 o
0.00141162249612 0.00000008197607 3.01262148875343 o
4.05947580693281 -0.00000015128153 0.12202776723928 h
-2.02883988453177 3.51548597828379 0.12131791511576 h
-2.02883995287005 -3.51548584962367 0.12131787884917 h
#HCP
0.00000000000000 0.00000000000000 -2.64853987727355 p
0.00000000000000 0.00000000000000 2.35551089579161 h
0.00000000000000 0.00000000000000 0.29302898148195 c
#HCl
0.00000000000000 0.00000000000000 -1.22530682104886 cl
0.00000000000000 0.00000000000000 1.22530682104886 h
#HSH
-0.00000891346937 1.19653856768716 0.00000000000000 s
1.84307080535555 -0.59826448731836 0.00000000000000 h
-1.84306189188618 -0.59827408036881 0.00000000000000 h
#HSSH
1.98198459838609 -0.07543787142517 0.90366573347496 s
-1.98198459838609 0.07543787142517 0.90366573347496 s
2.42926401991953 1.72380811808687 -0.90366607995143 h
-2.42926401991953 -1.72380811808687 -0.90366607995143 h
#P2
0.00000000000000 0.00000000000000 1.81038834147637 p
0.00000000000000 0.00000000000000 -1.81038834147637 p
#PF3
0.00190593228732 0.00000637856307 -1.13522248396255 p
2.65740159746508 0.00000628935462 0.38170793256163 f
-1.32964926884328 2.29968766474854 0.37675740109626 f
-1.32965826090911 -2.29970033266624 0.37675715030465 f
#PF5
0.00093568540199 0.00000556340549 0.00000000000000 p
0.00115403835462 -3.04805754510344 0.00000000000000 f
0.00115453827044 3.04805857150255 0.00000000000000 f
3.00853565827311 -0.00000245516935 0.00000000000000 f
-1.50588996015008 -0.00000206731762 2.60331280562780 f
-1.50588996015008 -0.00000206731762 -2.60331280562780 f
#PH3
0.00021868262881 0.00000408524970 -1.13254033248507 p
2.26639108333582 0.00000455950564 0.37803102689817 h
-1.13330963847505 1.96296552283309 0.37726390137846 h
-1.13330012748958 -1.96297416758843 0.37724540420844 h
#S2
0.00000000000000 0.00000000000000 -1.82795217547776 s
0.00000000000000 0.00000000000000 1.82795217547776 s
#S5
-1.01219286085597 0.91031071217532 2.78939529359939 s
2.56254320877922 -0.26701145071347 2.27262712733185 s
2.56256180032893 -0.26700825963793 -2.27262274065567 s
-1.01216802810249 0.91029852260584 -2.78940508703009 s
-3.10074412014967 -1.28658952442978 0.00000540675450 s
#SF2
0.00000000000000 0.00000000000000 1.32266337773884 s
2.37880811467657 0.00000000000000 -0.66133188418768 f
-2.37880811467657 0.00000000000000 -0.66133188418768 f
#SF4
-0.00000226380055 -0.00002431422764 0.84926009844488 s
-3.18886562268367 -0.00001733471558 0.66640784370306 f
3.18886006659826 -0.00001733422028 0.66642737569287 f
0.00000390405808 2.35445661105741 -1.09097973125881 f
0.00000391582787 -2.35439762789392 -1.09111558658199 f
#SF6
0.00000000000000 0.00000000000000 0.00000118515990 s
-2.15172851914079 -2.15172851914079 -0.00000033099473 f
0.00000000000000 0.00000000000000 3.04300291311907 f
-2.15172851914079 2.15172851914079 -0.00000033099473 f
0.00000000000000 0.00000000000000 -3.04300276329175 f
2.15172851914079 -2.15172851914079 -0.00000033099473 f
2.15172851914079 2.15172851914079 -0.00000033099473 f
#SiCl4
0.00000000000000 0.00000000000000 0.00000000000000 si
2.24180189786400 -2.24180189786400 2.24180189786400 cl
-2.24180189786400 2.24180189786400 2.24180189786400 cl
-2.24180189786400 -2.24180189786400 -2.24180189786400 cl
2.24180189786400 2.24180189786400 -2.24180189786400 cl
#SiF4
0.00000000000000 0.00000000000000 0.00000000000000 si
1.74748733068482 -1.74748733068482 1.74748733068482 f
-1.74748733068482 1.74748733068482 1.74748733068482 f
-1.74748733068482 -1.74748733068482 -1.74748733068482 f
1.74748733068482 1.74748733068482 -1.74748733068482 f
#SiH4
0.00000000000000 0.00000000000000 0.00000000000000 si
1.63806238513397 -1.63806238513397 1.63806238513397 h
-1.63806238513397 1.63806238513397 1.63806238513397 h
-1.63806238513397 -1.63806238513397 -1.63806238513397 h
1.63806238513397 1.63806238513397 -1.63806238513397 h
#SiO2
0.00000000000000 0.00000000000000 0.00000000000000 si
0.00000000000000 0.00000000000000 -2.90863957585795 o
0.00000000000000 0.00000000000000 2.90863957585795 o
#SiS2
0.00000000000000 0.00000000000000 0.00000000000000 si
0.00000000000000 0.00000000000000 -3.68153174204543 s
0.00000000000000 0.00000000000000 3.68153174204543 s
#As4
1.64900717955662 -1.64900717955662 1.64900717955662 as
-1.64900717955662 1.64900717955662 1.64900717955662 as
-1.64900717955662 -1.64900717955662 -1.64900717955662 as
1.64900717955662 1.64900717955662 -1.64900717955662 as
#As4S4
-1.41083883866857 -1.41083883866857 4.46081971940384 s
1.41083883866857 1.41083883866857 4.46081971940384 s
-1.41083883866857 1.41083883866857 -4.46081971940384 s
1.41083883866857 -1.41083883866857 -4.46081971940384 s
0.00000000000000 3.30253054743472 0.00000000000000 as
3.30253054743472 0.00000000000000 0.00000000000000 as
0.00000000000000 -3.30253054743472 0.00000000000000 as
-3.30253054743472 0.00000000000000 0.00000000000000 as
#AsCl3
0.00000000000000 0.00000000000000 1.45363897308538 as
-1.85326772975506 3.20995386796359 -0.48454632436179 cl
-1.85326772975506 -3.20995386796359 -0.48454632436179 cl
3.70653545951011 0.00000000000000 -0.48454632436179 cl
#AsCl6-
0.00000000000000 0.00000000000000 0.00000000000000 as
0.00000000000000 4.35128874572739 0.00000000000000 cl
0.00000000000000 0.00000000000000 4.35128874572739 cl
4.35128874572739 0.00000000000000 0.00000000000000 cl
0.00000000000000 0.00000000000000 -4.35128874572739 cl
-4.35128874572739 0.00000000000000 0.00000000000000 cl
0.00000000000000 -4.35128874572739 0.00000000000000 cl
#AsH3
0.00000000000000 0.00000000000000 1.23244998693740 as
-1.20159017904000 2.08121523997307 -0.41081666231247 h
-1.20159017904000 -2.08121523997307 -0.41081666231247 h
2.40318035808001 0.00000000000000 -0.41081666231247 h
#Br2
0.00000000000000 0.00000000000000 -2.20336345967580 br
0.00000000000000 0.00000000000000 2.20336345967580 br
#BrCl
0.00000000000000 0.00000000000000 -2.07645102410186 br
0.00000000000000 0.00000000000000 2.07645102410186 cl
#BrO4-
0.00000000000000 0.00000000000000 0.00000000000000 br
1.80474294078758 -1.80474294078758 1.80474294078758 o
-1.80474294078758 1.80474294078758 1.80474294078758 o
-1.80474294078758 -1.80474294078758 -1.80474294078758 o
1.80474294078758 1.80474294078758 -1.80474294078758 o
#GaCl
0.00000000000000 0.00000000000000 -2.11198999351902 ga
0.00000000000000 0.00000000000000 2.11198999351902 cl
#GaCl3
0.00000000000000 0.00000000000000 0.00000000000000 ga
2.02363708334148 -3.50504224442794 0.00000000000000 cl
2.02363708334148 3.50504224442794 0.00000000000000 cl
-4.04727416668296 0.00000000000000 0.00000000000000 cl
#GaF
0.00000000000000 0.00000000000000 -1.69732010119943 ga
0.00000000000000 0.00000000000000 1.69732010119943 f
#GaF2
0.00000000000000 0.00000000000000 1.16213096204235 ga
-2.87257490857190 0.00000000000000 -0.58106548102118 f
2.87257490857190 0.00000000000000 -0.58106548102118 f
#GaH3
0.00000000000000 0.00000000000000 0.00000000000000 ga
1.49230772481659 -2.58475279990984 0.00000000000000 h
1.49230772481659 2.58475279990984 0.00000000000000 h
-2.98461544963317 0.00000000000000 0.00000000000000 h
#GaO
0.00000000000000 0.00000000000000 -1.61698641616867 ga
0.00000000000000 0.00000000000000 1.61698641616867 o
#GeCl4
0.00000000000000 0.00000000000000 0.00000000000000 ge
2.34720419578646 -2.34720419578646 2.34720419578646 cl
-2.34720419578646 2.34720419578646 2.34720419578646 cl
-2.34720419578646 -2.34720419578646 -2.34720419578646 cl
2.34720419578646 2.34720419578646 -2.34720419578646 cl
#GeF3
0.00000000000000 0.00000000000000 0.93844457989423 ge
1.53348366776395 -2.65607162514423 -0.31281485996474 f
1.53348366776395 2.65607162514423 -0.31281485996474 f
-3.06696733552790 0.00000000000000 -0.31281485996474 f
#GeF4
0.00000000000000 0.00000000000000 0.00000000000000 ge
1.87482477759343 -1.87482477759343 1.87482477759343 f
-1.87482477759343 1.87482477759343 1.87482477759343 f
-1.87482477759343 -1.87482477759343 -1.87482477759343 f
1.87482477759343 1.87482477759343 -1.87482477759343 f
#GeH4
0.00000000000000 0.00000000000000 0.00000000000000 ge
1.69283500661777 -1.69283500661777 1.69283500661777 h
-1.69283500661777 1.69283500661777 1.69283500661777 h
-1.69283500661777 -1.69283500661777 -1.69283500661777 h
1.69283500661777 1.69283500661777 -1.69283500661777 h
#GeO
0.00000000000000 0.00000000000000 -1.55696412775958 ge
0.00000000000000 0.00000000000000 1.55696412775958 o
#GeO2
0.00000000000000 0.00000000000000 0.00000000000000 ge
0.00000000000000 0.00000000000000 3.09562411619127 o
0.00000000000000 0.00000000000000 -3.09562411619127 o
#HBr
0.00000000000000 0.00000000000000 -1.35667371651595 h
0.00000000000000 0.00000000000000 1.35667371651595 br
#HCBr3
0.00000000000000 0.00000000000000 0.22579559169999 c
0.00000000000000 0.00000000000000 2.30613641574210 h
1.76507167530612 -3.05719382063092 -0.84397733581403 br
1.76507167530612 3.05719382063092 -0.84397733581403 br
-3.53014335061225 0.00000000000000 -0.84397733581403 br
#Se8
4.73473332107232 -1.96119075580796 1.08203483157154 se
1.96119075580796 4.73473332107232 1.08203483157154 se
-4.73473332107232 1.96119075580796 1.08203483157154 se
-1.96119075580796 -4.73473332107232 1.08203483157154 se
4.73473332107232 1.96119075580796 -1.08203483157154 se
-1.96119075580796 4.73473332107232 -1.08203483157154 se
-4.73473332107232 -1.96119075580796 -1.08203483157154 se
1.96119075580796 -4.73473332107232 -1.08203483157154 se
#SeH2
0.00000000000000 0.00000000000000 1.31443756714499 se
-1.99442696033084 0.00000000000000 -0.65721878357249 h
1.99442696033084 0.00000000000000 -0.65721878357249 h
#SeO
0.00000000000000 0.00000000000000 -1.58117857273827 se
0.00000000000000 0.00000000000000 1.58117857273827 o
#SeO2
0.00000000000000 0.00000000000000 1.10091950638887 se
-2.61260008861725 0.00000000000000 -0.55045975319444 o
2.61260008861725 0.00000000000000 -0.55045975319444 o
#I2
0.00000000000000 0.00000000000000 -2.58717910006003 i
0.00000000000000 0.00000000000000 2.58717910006003 i
#ICl
0.00000000000000 0.00000000000000 -2.27749291163188 i
0.00000000000000 0.00000000000000 2.27749291163189 cl
#IH
0.00000000000000 0.00000000000000 -1.54901575226915 i
0.00000000000000 0.00000000000000 1.54901575226915 h
#IO4-
0.00000000000000 0.00000000000000 0.00000000000000 i
2.03119023188409 -2.03119023188409 2.03119023188409 o
-2.03119023188409 2.03119023188409 2.03119023188409 o
-2.03119023188409 -2.03119023188409 -2.03119023188409 o
2.03119023188409 2.03119023188409 -2.03119023188409 o
#InCl
0.00000000000000 0.00000000000000 -2.28501380453881 in
0.00000000000000 0.00000000000000 2.28501380453881 cl
#InCl3
0.00000000000000 0.00000000000000 0.00000000000000 in
-2.18888514352907 3.79126028052504 0.00000000000000 cl
-2.18888514352907 -3.79126028052504 0.00000000000000 cl
4.37777028705814 0.00000000000000 0.00000000000000 cl
#InH
0.00000000000000 0.00000000000000 -1.77323971157117 in
0.00000000000000 0.00000000000000 1.77323971157117 h
#InH3
0.00000000000000 0.00000000000000 0.00000000000000 in
-1.65719731255026 2.87034994350365 0.00000000000000 h
-1.65719731255026 -2.87034994350365 0.00000000000000 h
3.31439462510052 0.00000000000000 0.00000000000000 h
#InO
0.00000000000000 0.00000000000000 -1.77046376816122 in
0.00000000000000 0.00000000000000 1.77046376816122 o
#SbCl6-
0.00000000000000 0.00000000000000 0.00000000000000 sb
0.00000000000000 4.64447503829980 0.00000000000000 cl
0.00000000000000 0.00000000000000 4.64447503829980 cl
4.64447503829980 0.00000000000000 0.00000000000000 cl
0.00000000000000 0.00000000000000 -4.64447503829980 cl
-4.64447503829980 0.00000000000000 0.00000000000000 cl
0.00000000000000 -4.64447503829980 0.00000000000000 cl
#SbF
0.00000000000000 0.00000000000000 -1.86318815100045 sb
0.00000000000000 0.00000000000000 1.86318815100045 f
#SbF3
0.00000000000000 0.00000000000000 1.41635010067847 sb
-1.57661128992144 2.73077085793065 -0.47211670022616 f
-1.57661128992144 -2.73077085793065 -0.47211670022616 f
3.15322257984289 0.00000000000000 -0.47211670022616 f
#SbH3
0.00000000000000 0.00000000000000 1.40288124678412 sb
1.34916589534128 -2.33682387857025 -0.46762708226138 h
1.34916589534128 2.33682387857025 -0.46762708226138 h
-2.69833179068256 0.00000000000000 -0.46762708226138 h
#SbO2
0.00000000000000 0.00000000000000 1.18120858212824 sb
3.08998758817836 0.00000000000000 -0.59060429106412 o
-3.08998758817836 0.00000000000000 -0.59060429106412 o
#SnF3
0.00000000000000 0.00000000000000 1.07456818814013 sn
1.71243475756358 -2.96602400474702 -0.35818939604671 f
1.71243475756358 2.96602400474702 -0.35818939604671 f
-3.42486951512717 0.00000000000000 -0.35818939604671 f
#SnH4
0.00000000000000 0.00000000000000 0.00000000000000 sn
1.89044177023958 -1.89044177023958 1.89044177023958 h
-1.89044177023958 1.89044177023958 1.89044177023958 h
-1.89044177023958 -1.89044177023958 -1.89044177023958 h
1.89044177023958 1.89044177023958 -1.89044177023958 h
#SnO
0.00000000000000 0.00000000000000 -1.76719363698803 sn
0.00000000000000 0.00000000000000 1.76719363698803 o
#SnO2
0.00000000000000 0.00000000000000 0.00163548812459 sn
-3.51460840178293 0.00000000000000 -0.00081774406230 o
3.51460840178293 0.00000000000000 -0.00081774406230 o
#TeF3
0.00000000000000 0.00000000000000 0.35475666747305 te
-1.87725312652868 3.25149779381520 -0.11825222249101 f
-1.87725312652868 -3.25149779381520 -0.11825222249101 f
3.75450625305736 0.00000000000000 -0.11825222249101 f
#TeH2
0.00000000000000 0.00000000000000 1.49820193039170 te
-2.24906865611118 0.00000000000000 -0.74910096519585 h
2.24906865611118 0.00000000000000 -0.74910096519585 h
#TeO
0.00000000000000 0.00000000000000 -1.77896181226445 te
0.00000000000000 0.00000000000000 1.77896181226445 o
#TeO2
0.00000000000000 0.00000000000000 1.29984292231352 te
-2.88498675314837 0.00000000000000 -0.64992146115676 o
2.88498675314837 0.00000000000000 -0.64992146115676 o
#XeF2
0.00000000000000 0.00000000000000 0.00000000000000 xe
0.00000000000000 0.00000000000000 3.90757878328295 f
0.00000000000000 0.00000000000000 -3.90757878328295 f
#XeF4
0.00000000000000 0.00000000000000 0.00000000000000 xe
2.72236103703447 -2.72236103703447 0.00000000000000 f
2.72236103703447 2.72236103703447 0.00000000000000 f
-2.72236103703447 2.72236103703447 0.00000000000000 f
-2.72236103703447 -2.72236103703447 0.00000000000000 f
#XeOF4
0.00000000000000 0.00000000000000 -0.39099828949089 xe
0.00000000000000 0.00000000000000 3.04665434896357 o
2.70138310369918 -2.70138310369918 -0.66391401486817 f
2.70138310369918 2.70138310369918 -0.66391401486817 f
-2.70138310369918 2.70138310369918 -0.66391401486817 f
-2.70138310369918 -2.70138310369918 -0.66391401486817 f
#BiCl6-
0.00000000000000 0.00000000000000 0.00000000000000 bi
0.00000000000000 4.82554937284918 0.00000000000000 cl
0.00000000000000 0.00000000000000 4.82554937284918 cl
0.00000000000000 -4.82554937284918 0.00000000000000 cl
0.00000000000000 0.00000000000000 -4.82554937284918 cl
4.82554937284918 0.00000000000000 0.00000000000000 cl
-4.82554937284918 0.00000000000000 0.00000000000000 cl
#BiF
0.00000000000000 0.00000000000000 -1.93137769997131 bi
0.00000000000000 0.00000000000000 1.93137769997131 f
#BiF3
0.00000000000000 0.00000000000000 1.46232798160630 bi
1.63662897536318 -2.83472453846842 -0.48744266053543 f
1.63662897536318 2.83472453846842 -0.48744266053543 f
-3.27325795072636 0.00000000000000 -0.48744266053543 f
#BiH3
0.00000000000000 0.00000000000000 1.47386771700502 bi
1.40843659350503 -2.43948373918995 -0.49128923900167 h
1.40843659350503 2.43948373918995 -0.49128923900167 h
-2.81687318701006 0.00000000000000 -0.49128923900167 h
#BiO2
0.00000000000000 0.00000000000000 1.37289088296138 bi
-3.15041062335303 0.00000000000000 -0.68644544148069 o
3.15041062335303 0.00000000000000 -0.68644544148069 o
#PbF3
0.00000000000000 0.00000000000000 1.10329818701537 pb
-1.78036242435008 3.08367817486085 -0.36776606233846 f
-1.78036242435008 -3.08367817486085 -0.36776606233846 f
3.56072484870017 0.00000000000000 -0.36776606233846 f
#PbH4
0.00000000000000 0.00000000000000 0.00000000000000 pb
1.91301550123300 -1.91301550123300 1.91301550123300 h
-1.91301550123300 1.91301550123300 1.91301550123300 h
-1.91301550123300 -1.91301550123300 -1.91301550123300 h
1.91301550123300 1.91301550123300 -1.91301550123300 h
#PbO
0.00000000000000 0.00000000000000 -1.80754257937630 pb
0.00000000000000 0.00000000000000 1.80754257937630 o
#PbO2
0.00000000000000 0.00000000000000 0.00000000000000 pb
0.00000000000000 0.00000000000000 3.61357863592328 o
0.00000000000000 0.00000000000000 -3.61357863592328 o
#TlCl
0.00000000000000 0.00000000000000 -2.38342001986092 tl
0.00000000000000 0.00000000000000 2.38342001986092 cl
#TlCl3
0.00000000000000 0.00000000000000 -0.01443837177572 tl
-2.26117878730255 3.91647654460500 0.00481279059057 cl
-2.26117878730255 -3.91647654460500 0.00481279059057 cl
4.52235757460510 0.00000000000000 0.00481279059057 cl
#TlH
0.00000000000000 0.00000000000000 -1.81347675018980 tl
0.00000000000000 0.00000000000000 1.81347675018980 h
#TlH3
0.00000000000000 0.00000000000000 0.00000000000000 tl
-1.64536913789863 2.84986294404622 0.00000000000000 h
-1.64536913789863 -2.84986294404622 0.00000000000000 h
3.29073827579725 0.00000000000000 0.00000000000000 h
#TlO
0.00000000000000 0.00000000000000 -1.81795601245970 tl
0.00000000000000 0.00000000000000 1.81795601245970 o
#CoCl3
0.00000000000000 0.00000000000000 0.00000000000000 co
2.00502719350387 -3.47280896970594 0.00000000000000 cl
2.00502719350387 3.47280896970594 0.00000000000000 cl
-4.01005438700775 0.00000000000000 0.00000000000000 cl
#CoF2
0.00000000000000 0.00000000000000 -0.01591379082412 co
3.26355789294746 0.00000000000000 0.00795689541206 f
-3.26355789294746 0.00000000000000 0.00795689541206 f
#CoF3
0.00000000000000 0.00000000000000 0.00000000000000 co
1.65123154872552 -2.86001693745324 0.00000000000000 f
1.65123154872552 2.86001693745324 0.00000000000000 f
-3.30246309745104 0.00000000000000 0.00000000000000 f
#CrCO6
0.00000000000000 0.00000000000000 0.00000000000000 cr
0.00000000000000 3.59171681854581 0.00000000000000 c
0.00000000000000 0.00000000000000 3.59171681854581 c
3.59171681854581 0.00000000000000 0.00000000000000 c
0.00000000000000 0.00000000000000 -3.59171681854581 c
-3.59171681854581 0.00000000000000 0.00000000000000 c
0.00000000000000 -3.59171681854581 0.00000000000000 c
0.00000000000000 5.77973936611907 0.00000000000000 o
0.00000000000000 0.00000000000000 5.77973936611907 o
5.77973936611907 0.00000000000000 0.00000000000000 o
0.00000000000000 0.00000000000000 -5.77973936611907 o
-5.77973936611907 0.00000000000000 0.00000000000000 o
0.00000000000000 -5.77973936611907 0.00000000000000 o
#CrCl3
0.00000000000000 0.00000000000000 0.00000000000000 cr
2.02495084056461 -3.50731773868720 0.00000000000000 cl
2.02495084056461 3.50731773868720 0.00000000000000 cl
-4.04990168112921 0.00000000000000 0.00000000000000 cl
#CrF3
0.00000000000000 0.00000000000000 0.00000000000000 cr
1.63137792162153 -2.82562944659461 0.00000000000000 f
1.63137792162153 2.82562944659461 0.00000000000000 f
-3.26275584324306 0.00000000000000 0.00000000000000 f
#CrO3
0.00000000000000 0.00000000000000 0.00000000000000 cr
-1.50063115995876 2.59916941246959 0.00000000000000 o
-1.50063115995876 -2.59916941246959 0.00000000000000 o
3.00126231991752 0.00000000000000 0.00000000000000 o
#Cu2
0.00000000000000 0.00000000000000 -2.07387116344728 cu
0.00000000000000 0.00000000000000 2.07387116344728 cu
#Cu2O
0.00000000000000 0.00000000000000 1.63312192704579 o
2.28854347532692 0.00000000000000 -0.81656096352289 cu
-2.28854347532692 0.00000000000000 -0.81656096352289 cu
#Cu2S
0.00000000000000 0.00000000000000 2.19080233145777 s
-2.28384138036123 0.00000000000000 -1.09540116572889 cu
2.28384138036123 0.00000000000000 -1.09540116572889 cu
#CuCN
0.00000000000000 0.00000000000000 -3.01968451426437 cu
0.00000000000000 0.00000000000000 0.39611548720036 c
0.00000000000000 0.00000000000000 2.62356902706402 n
#CuCl
0.00000000000000 0.00000000000000 -1.95954303758138 cu
0.00000000000000 0.00000000000000 1.95954303758138 cl
#CuF
0.00000000000000 0.00000000000000 -1.64676654637877 cu
0.00000000000000 0.00000000000000 1.64676654637877 f
#CuH
0.00000000000000 0.00000000000000 -1.37926640891550 cu
0.00000000000000 0.00000000000000 1.37926640891550 h
#FeCO5
0.00000000000000 0.00000000000000 0.00000000000000 fe
1.70357480283978 -2.95067811301262 0.00000000000000 c
1.70357480283978 2.95067811301262 0.00000000000000 c
-3.40714960567955 0.00000000000000 0.00000000000000 c
0.00000000000000 0.00000000000000 3.40816318478371 c
0.00000000000000 0.00000000000000 -3.40816318478371 c
2.79922085086665 -4.84839273530721 0.00000000000000 o
2.79922085086665 4.84839273530721 0.00000000000000 o
-5.59844170173329 0.00000000000000 0.00000000000000 o
0.00000000000000 0.00000000000000 5.59447063964439 o
0.00000000000000 0.00000000000000 -5.59447063964439 o
#FeF2
0.00000000000000 0.00000000000000 0.00000000000000 fe
3.29988416615965 0.00000000000000 0.00000000000000 f
-3.29988416615965 0.00000000000000 0.00000000000000 f
#FeF3
0.00000000000000 0.00000000000000 0.00000000000000 fe
1.67360598116772 -2.89877059123365 0.00000000000000 f
1.67360598116772 2.89877059123365 0.00000000000000 f
-3.34721196233544 0.00000000000000 0.00000000000000 f
#FeO
-0.66907143281002 0.00000000000000 0.00000000000000 fe
2.33556505384199 0.00000000000000 0.00000000000000 o
#Ferrocen
0.00000000000000 0.00000000000000 0.00000000000000 fe
2.31561104541701 0.00000000000000 3.09927116392114 c
0.71556316539619 2.20227697394888 3.09927116392114 c
-1.87336868810470 1.36108202254167 3.09927116392114 c
-1.87336868810470 -1.36108202254167 3.09927116392114 c
0.71556316539619 -2.20227697394888 3.09927116392114 c
2.31561104541701 0.00000000000000 -3.09927116392114 c
0.71556316539619 -2.20227697394888 -3.09927116392114 c
-1.87336868810470 -1.36108202254167 -3.09927116392114 c
-1.87336868810470 1.36108202254167 -3.09927116392114 c
0.71556316539619 2.20227697394888 -3.09927116392114 c
4.38900985665904 0.00000000000000 3.08518706538327 h
1.35627863418680 4.17419642425924 3.08518706538327 h
-3.55078356251632 2.57979526591049 3.08518706538327 h
-3.55078356251632 -2.57979526591049 3.08518706538327 h
1.35627863418680 -4.17419642425924 3.08518706538327 h
4.38900985665904 0.00000000000000 -3.08518706538327 h
1.35627863418680 -4.17419642425924 -3.08518706538327 h
-3.55078356251632 -2.57979526591049 -3.08518706538327 h
-3.55078356251632 2.57979526591049 -3.08518706538327 h
1.35627863418680 4.17419642425924 -3.08518706538327 h
#MnF2
0.00000000000000 0.00000000000000 0.00000000000000 mn
0.00000000000000 0.00000000000000 3.36165918231541 f
0.00000000000000 0.00000000000000 -3.36165918231541 f
#MnO
0.00000000000000 0.00000000000000 -1.52065965443162 mn
0.00000000000000 0.00000000000000 1.52065965443162 o
#MnO2
0.00000000000000 0.00000000000000 0.91350357143973 mn
2.66795187804954 0.00000000000000 -0.45675178571986 o
-2.66795187804954 0.00000000000000 -0.45675178571986 o
#MnO3F
0.00000000000000 0.00000000000000 -0.07330413800993 mn
0.00000000000000 0.00000000000000 3.16649627047248 f
1.40721736620792 -2.43737197556538 -1.03106404415419 o
1.40721736620792 2.43737197556538 -1.03106404415419 o
-2.81443473241584 0.00000000000000 -1.03106404415419 o
#MnO4-
0.00000000000000 0.00000000000000 0.00000000000000 mn
1.75938547049818 -1.75938547049818 1.75938547049818 o
-1.75938547049818 1.75938547049818 1.75938547049818 o
-1.75938547049818 -1.75938547049818 -1.75938547049818 o
1.75938547049818 1.75938547049818 -1.75938547049818 o
#MnS
0.00000000000000 0.00000000000000 -1.92619713055598 mn
0.00000000000000 0.00000000000000 1.92619713055598 s
#NiCO4
0.00000000000000 0.00000000000000 0.00000000000000 ni
1.98326378231725 -1.98326378231725 1.98326378231725 c
-1.98326378231725 1.98326378231725 1.98326378231725 c
-1.98326378231725 -1.98326378231725 -1.98326378231725 c
1.98326378231725 1.98326378231725 -1.98326378231725 c
3.24273654096679 -3.24273654096679 3.24273654096679 o
-3.24273654096679 3.24273654096679 3.24273654096679 o
-3.24273654096679 -3.24273654096679 -3.24273654096679 o
3.24273654096679 3.24273654096679 -3.24273654096679 o
#NiCl2
0.00000000000000 0.00000000000000 0.00232084864856 ni
-3.96670138124145 0.00000000000000 -0.00116042432428 cl
3.96670138124145 0.00000000000000 -0.00116042432428 cl
#NiF2
0.00000000000000 0.00000000000000 0.00000000000000 ni
0.00000000000000 0.00000000000000 -3.26603962131760 f
0.00000000000000 0.00000000000000 3.26603962131760 f
#NiF3
0.00000000000000 0.00000000000000 0.00152306552660 ni
-1.66351766562508 2.88129711615101 -0.00050768850887 f
-1.66351766562508 -2.88129711615101 -0.00050768850887 f
3.32703533125016 0.00000000000000 -0.00050768850887 f
#NiO
0.00000000000000 0.00000000000000 -1.51749092920855 ni
0.00000000000000 0.00000000000000 1.51749092920855 o
#NiS
0.00000000000000 0.00000000000000 -1.85681514730456 ni
0.00000000000000 0.00000000000000 1.85681514730456 s
#ScCl3
0.00000000000000 0.00000000000000 0.00000000000000 sc
2.15416668810895 -3.73112615177708 0.00000000000000 cl
2.15416668810895 3.73112615177708 0.00000000000000 cl
-4.30833337621790 0.00000000000000 0.00000000000000 cl
#ScF3
0.00000000000000 0.00000000000000 0.00000000000000 sc
1.73202055035891 -2.99994759297505 0.00000000000000 f
1.73202055035891 2.99994759297505 0.00000000000000 f
-3.46404110071783 0.00000000000000 0.00000000000000 f
#ScH3
0.00000000000000 0.00000000000000 0.00000000000000 sc
1.71347214324408 -2.96782080945268 0.00000000000000 h
1.71347214324408 2.96782080945268 0.00000000000000 h
-3.42694428648816 0.00000000000000 0.00000000000000 h
#ScO
0.00000000000000 0.00000000000000 -1.57175591846256 sc
0.00000000000000 0.00000000000000 1.57175591846256 o
#TiCO4
0.00000000000000 0.00000000000000 0.00000000000000 ti
2.25209609785139 -2.25209609785139 2.25209609785139 c
-2.25209609785139 2.25209609785139 2.25209609785139 c
-2.25209609785139 -2.25209609785139 -2.25209609785139 c
2.25209609785139 2.25209609785139 -2.25209609785139 c
3.52294080235074 -3.52294080235074 3.52294080235074 o
-3.52294080235074 3.52294080235074 3.52294080235074 o
-3.52294080235074 -3.52294080235074 -3.52294080235074 o
3.52294080235074 3.52294080235074 -3.52294080235074 o
#TiCl4
0.00000000000000 0.00000000000000 0.00000000000000 ti
2.38225918250055 -2.38225918250055 2.38225918250055 cl
-2.38225918250055 2.38225918250055 2.38225918250055 cl
-2.38225918250055 -2.38225918250055 -2.38225918250055 cl
2.38225918250055 2.38225918250055 -2.38225918250055 cl
#TiF3
0.00000000000000 0.00000000000000 0.00000000000000 ti
1.67141378359608 -2.89497359365934 0.00000000000000 f
1.67141378359608 2.89497359365934 0.00000000000000 f
-3.34282756719215 0.00000000000000 0.00000000000000 f
#TiF4
0.00000000000000 0.00000000000000 0.00000000000000 ti
1.91049002205680 -1.91049002205680 1.91049002205680 f
-1.91049002205680 1.91049002205680 1.91049002205680 f
-1.91049002205680 -1.91049002205680 -1.91049002205680 f
1.91049002205680 1.91049002205680 -1.91049002205680 f
#TiH4
0.00000000000000 0.00000000000000 0.00000000000000 ti
1.85401673992524 -1.85401673992524 1.85401673992524 h
-1.85401673992524 1.85401673992524 1.85401673992524 h
-1.85401673992524 -1.85401673992524 -1.85401673992524 h
1.85401673992524 1.85401673992524 -1.85401673992524 h
#TiO
0.00000000000000 0.00000000000000 -1.52666508702031 ti
0.00000000000000 0.00000000000000 1.52666508702031 o
#TiO2
0.00000000000000 0.00000000000000 1.20428895304113 ti
-2.52745691819368 0.00000000000000 -0.60214447652056 o
2.52745691819368 0.00000000000000 -0.60214447652056 o
#TiS2
0.00000000000000 0.00000000000000 1.47408703528939 ti
-3.26474084717958 0.00000000000000 -0.73704351764470 s
3.26474084717958 0.00000000000000 -0.73704351764470 s
#VH5
0.19112681055705 0.02226992514811 -0.53930273355572 v
1.21909073594429 0.14802719321707 -3.48934725444155 h
1.35539695757176 -1.88711320691551 1.52413775854092 h
1.36313902267154 1.74011620101324 1.68211209473418 h
-2.05809542406512 1.79208170165047 0.49003911695103 h
-2.07065810267952 -1.81538181411337 0.33236101777113 h
#VO
0.00000000000000 0.00000000000000 -1.49605986356322 v
0.00000000000000 0.00000000000000 1.49605986356322 o
#VOF3
0.00000000000000 0.00000000000000 0.02138488636646 v
0.00000000000000 0.00000000000000 2.99447623694060 o
-1.54851197430779 2.68210141562988 -1.00528704110235 f
-1.54851197430779 -2.68210141562988 -1.00528704110235 f
3.09702394861558 0.00000000000000 -1.00528704110235 f
#ZnCl2
0.00000000000000 0.00000000000000 0.00000000000000 zn
0.00000000000000 0.00000000000000 3.97259040076298 cl
0.00000000000000 0.00000000000000 -3.97259040076298 cl
#ZnF2
0.00000000000000 0.00000000000000 0.00000000000000 zn
0.00000000000000 0.00000000000000 3.28287621534218 f
0.00000000000000 0.00000000000000 -3.28287621534218 f
#ZnH2
0.00000000000000 0.00000000000000 0.00000000000000 zn
0.00000000000000 0.00000000000000 -2.92711569055511 h
0.00000000000000 0.00000000000000 2.92711569055511 h
#ZnMe2
3.68342584557891 0.00005713689622 0.00026506182462 c
-3.68356713887322 0.00023772392501 0.00027909608166 c
4.44876667227890 1.40886676936816 -1.35377226518157 h
4.44905348065180 -1.87650086846691 -0.54356099559000 h
4.45013283461305 0.46800749693417 1.89658631099636 h
-4.44857871394426 1.21933922067696 -1.52675501888773 h
-4.45004569978716 0.71048953578705 1.82005490636899 h
-4.44913036491722 -1.93120927472341 -0.29420173043471 h
-0.00005691560083 0.00071225960275 0.00110463482239 zn
#Ag2
0.00000000000000 0.00000000000000 -2.43284975341900 ag
0.00000000000000 0.00000000000000 2.43284975341900 ag
#AgCl
0.00000000000000 0.00000000000000 -2.17427221124677 ag
0.00000000000000 0.00000000000000 2.17427221124677 cl
#CdF2
0.00000000000000 0.00000000000000 0.00000000000000 cd
0.00000000000000 0.00000000000000 3.65399698977701 f
0.00000000000000 0.00000000000000 -3.65399698977701 f
#CdMe2
-0.01552765207821 -0.00211074960291 -0.00256455209819 cd
-0.00518470223702 -0.00014740649893 4.03174197678488 c
-0.00362618205013 -0.00022460589332 -4.02970589844624 c
1.03909570930236 1.66912049287321 4.74981657043364 h
0.94231936085281 -1.72490849239420 4.75261331167082 h
-1.95136186467702 0.05616956014136 4.80782591209543 h
-1.54974432309212 -1.20222871244731 -4.77501608328692 h
1.81386811131603 -0.73818341030734 -4.76612177697937 h
-0.26983845733673 1.94251332412944 -4.76858946017406 h
#MoCO6
0.00000000000000 0.00000000000000 0.00000000000000 mo
0.00000000000000 3.90295652556995 0.00000000000000 c
0.00000000000000 0.00000000000000 3.90295652556995 c
3.90295652556995 0.00000000000000 0.00000000000000 c
0.00000000000000 0.00000000000000 -3.90295652556995 c
-3.90295652556995 0.00000000000000 0.00000000000000 c
0.00000000000000 -3.90295652556995 0.00000000000000 c
0.00000000000000 6.09006160839460 0.00000000000000 o
0.00000000000000 0.00000000000000 6.09006160839460 o
6.09006160839460 0.00000000000000 0.00000000000000 o
0.00000000000000 0.00000000000000 -6.09006160839460 o
-6.09006160839460 0.00000000000000 0.00000000000000 o
0.00000000000000 -6.09006160839460 0.00000000000000 o
#MoF3
0.00000000000000 0.00000000000000 -0.00159671171885 mo
1.77637872237622 -3.07677820063990 0.00053223723962 f
1.77637872237622 3.07677820063990 0.00053223723962 f
-3.55275744475244 0.00000000000000 0.00053223723962 f
#MoH
0.00000000000000 0.00000000000000 -1.62042478286011 mo
0.00000000000000 0.00000000000000 1.62042478286011 h
#MoO2
0.00000000000000 0.00000000000000 1.20329050676615 mo
2.70432477568260 0.00000000000000 -0.60164525338307 o
-2.70432477568260 0.00000000000000 -0.60164525338307 o
#MoO3
0.00000000000000 0.00000000000000 -0.87497023552764 mo
-1.52984968466562 2.64977738178409 0.29165674517588 o
-1.52984968466562 -2.64977738178409 0.29165674517588 o
3.05969936933125 0.00000000000000 0.29165674517588 o
#NbF3
0.00000000000000 0.00000000000000 0.00000000000000 nb
-1.76123486076723 3.05054826291034 0.00000000000000 f
-1.76123486076723 -3.05054826291034 0.00000000000000 f
3.52246972153446 0.00000000000000 0.00000000000000 f
#NbO
0.00000000000000 0.00000000000000 1.61827909896555 nb
0.00000000000000 0.00000000000000 -1.61827909896555 o
#NbO2
0.00000000000000 0.00000000000000 1.35090407793570 nb
2.58725120191969 0.00000000000000 -0.67545203896785 o
-2.58725120191969 0.00000000000000 -0.67545203896785 o
#NbO2F
-0.02610891780556 0.86342528822632 0.06758988948919 nb
2.62395976524113 0.01237672503655 -1.69666564370223 o
-2.62102600254883 -0.14687228651066 -1.69136676770083 o
0.02317515511327 -0.72892972675222 3.32044252191387 f
#PdCO4
0.00000919143467 0.00000531380106 -0.00001191622877 pd
2.18351277656177 2.18350949811326 2.18351805760958 c
-2.18350195361372 -2.18350090015659 2.18350128273601 c
2.18351494366302 -2.18352263605300 -2.18351671330313 c
-2.18351964856344 2.18351087841231 -2.18351593700892 c
3.44064404148229 3.44064088770018 3.44067413451479 o
-3.44064406985283 -3.44062025793711 3.44067735832652 o
3.44066163241694 -3.44068081079362 -3.44066336280415 o
-3.44067691352870 3.44065802691347 -3.44066290384197 o
#PdF
0.00000000000000 0.00000000000000 -1.82090621303246 pd
0.00000000000000 0.00000000000000 1.82090621303246 f
#PdO2
0.00000000000000 0.00000000000000 0.00368780697011 pd
-3.56296972714997 0.00000000000000 -0.00184390348506 o
3.56296972714997 0.00000000000000 -0.00184390348506 o
#RhF
0.00000000000000 0.00000000000000 -1.80303434766506 rh
0.00000000000000 0.00000000000000 1.80303434766506 f
#RhF4
0.00000000000000 0.00000000000000 0.00000000000000 rh
2.11095283269456 -2.11095283269456 2.11095283269456 f
-2.11095283269456 2.11095283269456 2.11095283269456 f
-2.11095283269456 -2.11095283269456 -2.11095283269456 f
2.11095283269456 2.11095283269456 -2.11095283269456 f
#RhF6
0.00000000000000 0.00000000000000 0.00000000000000 rh
2.51299833250292 -2.51299833250292 0.00000000000000 f
2.51299833250292 2.51299833250292 0.00000000000000 f
-2.51299833250292 2.51299833250292 0.00000000000000 f
-2.51299833250292 -2.51299833250292 0.00000000000000 f
0.00000000000000 0.00000000000000 3.55393480343994 f
0.00000000000000 0.00000000000000 -3.55393480343994 f
#RhO
0.00000000000000 0.00000000000000 -1.63450098884323 rh
0.00000000000000 0.00000000000000 1.63450098884323 o
#RuCO5
0.00000000000000 0.00000000000000 0.00000000000000 ru
1.84480011535838 -3.19528752960964 0.00000000000000 c
1.84480011535838 3.19528752960964 0.00000000000000 c
-3.68960023071676 0.00000000000000 0.00000000000000 c
0.00000000000000 0.00000000000000 3.69125554048716 c
0.00000000000000 0.00000000000000 -3.69125554048716 c
2.94039490193387 -5.09291336446596 0.00000000000000 o
2.94039490193387 5.09291336446596 0.00000000000000 o
-5.88078980386773 0.00000000000000 0.00000000000000 o
0.00000000000000 0.00000000000000 5.87379294085885 o
0.00000000000000 0.00000000000000 -5.87379294085885 o
#RuF
0.00000000000000 0.00000000000000 -1.79559672059692 ru
0.00000000000000 0.00000000000000 1.79559672059692 f
#RuO
0.00000000000000 0.00000000000000 -1.63370929862074 ru
0.00000000000000 0.00000000000000 1.63370929862074 o
#RuO2
0.00000000000000 0.00000000000000 0.00000000000000 ru
0.00000000000000 0.00000000000000 3.22936844775946 o
0.00000000000000 0.00000000000000 -3.22936844775946 o
#RuO4
-0.00003901512132 -0.00004974867915 0.00003175074579 ru
1.87142850130396 1.87147977103538 1.87148905199029 o
-1.87142232278019 -1.87137312944410 1.87142093412647 o
1.87151789303364 -1.87153124203117 -1.87151937514838 o
-1.87148505643610 1.87147434911906 -1.87142236171416 o
#Tc2O7
0.00000000000000 0.00000000000000 0.00000000000000 o
0.00000000000000 0.00000000000000 3.55098914866315 tc
0.00000000000000 0.00000000000000 -3.55098914866315 tc
2.62571861860354 -1.51595935126696 4.65860875354015 o
2.62571861860354 1.51595935126696 -4.65860875354015 o
0.00000000000000 3.03191870253393 4.65860875354015 o
-2.62571861860354 1.51595935126696 -4.65860875354015 o
-2.62571861860354 -1.51595935126696 4.65860875354015 o
0.00000000000000 -3.03191870253393 -4.65860875354015 o
#TcO
0.00000000000000 0.00000000000000 -1.65131440458535 tc
0.00000000000000 0.00000000000000 1.65131440458535 o
#TcO3F
0.00000000000000 0.00000000000000 -0.03575380241616 tc
0.00000000000000 0.00000000000000 3.47832150786421 f
1.51189127548743 -2.61867250466434 -1.14752256848268 o
1.51189127548743 2.61867250466434 -1.14752256848268 o
-3.02378255097485 0.00000000000000 -1.14752256848268 o
#YF
0.00000000000000 0.00000000000000 -1.84234806551158 y
0.00000000000000 0.00000000000000 1.84234806551158 f
#YF3
0.00000000000000 0.00000000000000 0.00977112603694 y
-1.89922978387516 3.28956248091983 -0.00325704201177 f
-1.89922978387516 -3.28956248091983 -0.00325704201177 f
3.79845956775031 0.00000000000000 -0.00325704201177 f
#YO
0.00000000000000 0.00000000000000 -1.72806290572366 y
0.00000000000000 0.00000000000000 1.72806290572366 o
#ZrF
0.00000000000000 0.00000000000000 -1.78049044438309 zr
0.00000000000000 0.00000000000000 1.78049044438309 f
#ZrF3
0.00000000000000 0.00000000000000 0.00444657710922 zr
-1.82070257365541 3.15354936304259 -0.00148219236669 f
-1.82070257365541 -3.15354936304259 -0.00148219236669 f
3.64140514731082 0.00000000000000 -0.00148219236669 f
#ZrO
0.00000000000000 0.00000000000000 -1.66498802952802 zr
0.00000000000000 0.00000000000000 1.66498802952802 o
#ZrO2
0.00000000000000 0.00000000000000 1.36096020616404 zr
-2.71171774062042 0.00000000000000 -0.68048010308202 o
2.71171774062042 0.00000000000000 -0.68048010308202 o
#Au2
0.00000000000000 0.00000000000000 -2.42327065240856 au
0.00000000000000 0.00000000000000 2.42327065240856 au
#Au3-
0.00000000000000 0.00000000000000 0.00000000000000 au
0.00000000000000 0.00000000000000 4.97146253204511 au
0.00000000000000 0.00000000000000 -4.97146253204511 au
#AuCl
0.00000000000000 0.00000000000000 -2.15000661513040 au
0.00000000000000 0.00000000000000 2.15000661513040 cl
#AuCl3
0.00000000000000 0.00000000000000 0.00000000000000 au
2.21054988848081 -3.82878471951448 0.00000000000000 cl
2.21054988848081 3.82878471951448 0.00000000000000 cl
-4.42109977696162 0.00000000000000 0.00000000000000 cl
#HfF
0.00000000000000 0.00000000000000 1.78068737689156 hf
0.00000000000000 0.00000000000000 -1.78068737689156 f
#HfF3
0.00000000000000 0.00000000000000 0.00000000000000 hf
1.81947112203196 -3.15141642626371 0.00000000000000 f
1.81947112203196 3.15141642626371 0.00000000000000 f
-3.63894224406392 0.00000000000000 0.00000000000000 f
#HfO
0.00000000000000 0.00000000000000 -1.66226332616427 hf
0.00000000000000 0.00000000000000 1.66226332616427 o
#HfO2
0.00000000000000 0.00000000000000 1.37910110648005 hf
2.72240351204331 0.00000000000000 -0.68955055324002 o
-2.72240351204331 0.00000000000000 -0.68955055324002 o
#HgF2
0.00000000000000 0.00000000000000 0.00000000000000 hg
0.00000000000000 0.00000000000000 -3.69723523229824 f
0.00000000000000 0.00000000000000 3.69723523229824 f
#HgMe2
0.00000000000000 0.00000000000000 0.00000000000000 hg
0.00000000000000 0.00000000000000 4.03656130521134 c
0.00000000000000 0.00000000000000 -4.03656130521134 c
1.70138176612670 -0.98229322066757 4.76366724761748 h
1.70138176612670 0.98229322066757 -4.76366724761748 h
0.00000000000000 1.96458644133514 4.76366724761748 h
-1.70138176612670 0.98229322066757 -4.76366724761748 h
-1.70138176612670 -0.98229322066757 4.76366724761748 h
0.00000000000000 -1.96458644133514 -4.76366724761748 h
#Hg2Cl2
-0.00092289111444 -2.49971029372210 0.00000000000000 hg
0.00086843425201 2.49894980264274 0.00000000000000 hg
0.00005416705884 -6.97426742991672 0.00000000000000 cl
0.00000028980360 6.97502792099608 0.00000000000000 cl
#IrF6
0.00000000000000 0.00000000000000 0.00000000000000 ir
0.00000000000000 0.00000000000000 3.59726293025323 f
0.00000000000000 0.00000000000000 -3.59726293025323 f
2.54361009647590 -2.54361009647590 0.00000000000000 f
2.54361009647590 2.54361009647590 0.00000000000000 f
-2.54361009647590 2.54361009647590 0.00000000000000 f
-2.54361009647590 -2.54361009647590 0.00000000000000 f
#OsCO5
0.00000000000000 0.00000000000000 0.00000000000000 os
1.86245714222963 -3.22587039726125 0.00000000000000 c
1.86245714222963 3.22587039726125 0.00000000000000 c
-3.72491428445925 0.00000000000000 0.00000000000000 c
0.00000000000000 0.00000000000000 3.74847701997556 c
0.00000000000000 0.00000000000000 -3.74847701997556 c
2.95959230898802 -5.12616424885734 0.00000000000000 o
2.95959230898802 5.12616424885734 0.00000000000000 o
-5.91918461797604 0.00000000000000 0.00000000000000 o
0.00000000000000 0.00000000000000 5.93170395303675 o
0.00000000000000 0.00000000000000 -5.93170395303675 o
#OsO2
0.00000000000000 0.00000000000000 -0.90139173199185 os
2.96334365356516 0.00000000000000 0.45069586599592 o
-2.96334365356516 0.00000000000000 0.45069586599592 o
#OsO3
0.00000000000000 0.00000000000000 0.00000000000000 os
1.63177166219432 -2.82631142527168 0.00000000000000 o
1.63177166219432 2.82631142527168 0.00000000000000 o
-3.26354332438864 0.00000000000000 0.00000000000000 o
#OsO4
0.00000000000000 0.00000000000000 0.00000000000000 os
1.90033009057400 -1.90033009057400 1.90033009057400 o
-1.90033009057400 1.90033009057400 1.90033009057400 o
-1.90033009057400 -1.90033009057400 -1.90033009057400 o
1.90033009057400 1.90033009057400 -1.90033009057400 o
#OsOF5
0.00000000000000 0.00000000000000 0.22822360502953 os
0.00000000000000 0.00000000000000 3.47998909744502 o
0.00000000000000 0.00000000000000 -3.39562990080580 f
-2.53530418774888 2.53530418774888 -0.07814570041718 f
-2.53530418774888 -2.53530418774888 -0.07814570041718 f
2.53530418774888 -2.53530418774888 -0.07814570041718 f
2.53530418774888 2.53530418774888 -0.07814570041718 f
#PtCO4
0.00000000000000 0.00000000000000 0.00000000000000 pt
2.17219503977633 -2.17219503977633 2.17219503977633 c
-2.17219503977633 2.17219503977633 2.17219503977633 c
-2.17219503977633 -2.17219503977633 -2.17219503977633 c
2.17219503977633 2.17219503977633 -2.17219503977633 c
3.43196912076035 -3.43196912076035 3.43196912076035 o
-3.43196912076035 3.43196912076035 3.43196912076035 o
-3.43196912076035 -3.43196912076035 -3.43196912076035 o
3.43196912076035 3.43196912076035 -3.43196912076035 o
#PtO
0.00000000000000 0.00000000000000 -1.67069134020836 pt
0.00000000000000 0.00000000000000 1.67069134020836 o
#PtO2
0.00000000000000 0.00000000000000 0.00000000000000 pt
0.00000000000000 0.00000000000000 -3.28869598692728 o
0.00000000000000 0.00000000000000 3.28869598692728 o
#ReH
0.00000000000000 0.00000000000000 -1.56532428006416 re
0.00000000000000 0.00000000000000 1.56532428006416 h
#ReO
0.00000000000000 0.00000000000000 -1.67864437842535 re
0.00000000000000 0.00000000000000 1.67864437842535 o
#ReO2
0.00000000000000 0.00000000000000 0.00000000000000 re
0.00000000000000 0.00000000000000 -3.36557123070835 o
0.00000000000000 0.00000000000000 3.36557123070835 o
#ReO3
0.00000000000000 0.00000000000000 0.00000000000000 re
-1.64935415797960 2.85676520129566 0.00000000000000 o
-1.64935415797960 -2.85676520129566 0.00000000000000 o
3.29870831595921 0.00000000000000 0.00000000000000 o
#ReO3F
0.00000000000000 0.00000000000000 -0.00862182543285 re
0.00000000000000 0.00000000000000 3.55207214412449 f
-1.52651151621215 2.64399550441844 -1.18115010623055 o
-1.52651151621215 -2.64399550441844 -1.18115010623055 o
3.05302303242429 0.00000000000000 -1.18115010623055 o
#TaF
0.00000000000000 0.00000000000000 -1.73663852825574 ta
0.00000000000000 0.00000000000000 1.73663852825574 f
#TaF3
0.00000000000000 0.00000000000000 -0.00088004990885 ta
-1.76481713541870 3.05675294461335 0.00029334996962 f
-1.76481713541870 -3.05675294461335 0.00029334996962 f
3.52963427083740 0.00000000000000 0.00029334996962 f
#TaO2F
0.00000000000000 0.00000000000000 0.03006542312973 ta
0.00000000000000 0.00000000000000 3.72739793762169 f
2.74274130577697 0.00000000000000 -1.87873168037571 o
-2.74274130577697 0.00000000000000 -1.87873168037571 o
#WCO6
0.00000000000000 0.00000000000000 0.00000000000000 w
0.00000000000000 3.93720141856123 0.00000000000000 c
0.00000000000000 0.00000000000000 3.93720141856123 c
3.93720141856123 0.00000000000000 0.00000000000000 c
0.00000000000000 0.00000000000000 -3.93720141856123 c
-3.93720141856123 0.00000000000000 0.00000000000000 c
0.00000000000000 -3.93720141856123 0.00000000000000 c
0.00000000000000 6.12568593744740 0.00000000000000 o
0.00000000000000 0.00000000000000 6.12568593744740 o
6.12568593744740 0.00000000000000 0.00000000000000 o
0.00000000000000 0.00000000000000 -6.12568593744740 o
-6.12568593744740 0.00000000000000 0.00000000000000 o
0.00000000000000 -6.12568593744740 0.00000000000000 o
#WF3
0.00000000000000 0.00000000000000 0.00187166361740 w
-1.79324602416154 3.10599322431868 -0.00062388787247 f
-1.79324602416154 -3.10599322431868 -0.00062388787247 f
3.58649204832309 0.00000000000000 -0.00062388787247 f
#WH
0.00000000000000 0.00000000000000 -1.62254316912897 w
0.00000000000000 0.00000000000000 1.62254316912897 h
#WO
0.00000000000000 0.00000000000000 -1.58822148469933 w
0.00000000000000 0.00000000000000 1.58822148469933 o
#WO2
0.00000000000000 0.00000000000000 1.21145734769756 w
-2.74201323107353 0.00000000000000 -0.60572867384878 o
2.74201323107353 0.00000000000000 -0.60572867384878 o
#WO3
0.00000000000000 0.00000000000000 0.00000000000000 w
1.67015014718729 -2.89278491119702 0.00000000000000 o
1.67015014718729 2.89278491119702 0.00000000000000 o
-3.34030029437458 0.00000000000000 0.00000000000000 o
