#MD System 2.0 @Title neb0_image06 @Columns AsymmetricAtom AtomicNumber int 0 Connections string {{}} Fractional double {{0.0 0.0 0.0}} Name string {{}} Site int 1 Spin double 0.0 WyckoffPosition int -1 @end @data 14 {} {0.848956492483 0.307547404281 0.0629650344108} Si1 1 0.0 1 14 {} {0.849488871733 0.385213157812 0.444496162203} Si2 2 0.0 1 14 {} {0.0988522593518 0.307298320481 0.192476176518} Si3 3 0.0 1 14 {} {0.09883868787 0.383423994686 0.317592621584} Si4 4 0.0 1 14 {} {0.85795155357 0.54182375523 0.437141528601} Si5 5 0.0 1 14 {} {0.102747814812 0.537467700929 0.306455109199} Si6 6 0.0 1 14 {} {0.84737969032 0.458913170955 0.066442912231} Si7 7 0.0 1 14 {} {0.845299585416 0.229658951196 0.442012843927} Si8 8 0.0 1 14 {} {0.0993417084513 0.458490490981 0.191796822326} Si9 9 0.0 1 14 {} {0.0951213656367 0.228898291207 0.314004543595} Si10 10 0.0 1 8 {} {0.356856788558 0.59484306633 0.517581527181} O1 11 0.0 1 14 {} {0.323139917237 0.658174267217 0.522097541851} Si11 12 0.0 1 8 {} {0.111936004893 0.589800092984 0.210799155496} O2 13 0.0 1 1 {} {0.0127543451471 0.593624122027 0.150169216804} H1 14 0.0 1 8 {} {0.334309118223 0.177960880705 0.540722463752} O3 15 0.0 1 1 {} {0.933330231675 0.175105834335 0.601323766457} H2 16 0.0 1 8 {} {0.0839909626311 0.177155977305 0.215985829909} O4 17 0.0 1 1 {} {0.183050495828 0.173704443205 0.15583972807} H3 18 0.0 1 14 {} {0.849358110654 0.307937649932 0.564965288329} Si12 19 0.0 1 14 {} {0.849296470076 0.384272704796 0.939228053327} Si13 20 0.0 1 14 {} {0.0990854378928 0.308791860773 0.694044000839} Si14 21 0.0 1 14 {} {0.0999794074185 0.38705915038 0.812727648526} Si15 22 0.0 1 14 {} {0.849086030324 0.537158312173 0.948755585298} Si16 23 0.0 1 14 {} {0.0997436967352 0.542618430692 0.824739946296} Si17 24 0.0 1 14 {} {0.850819027113 0.464054842635 0.561608406013} Si18 25 0.0 1 14 {} {0.845366827887 0.228885913051 0.942478241245} Si19 26 0.0 1 14 {} {0.0997675748749 0.464976199336 0.690557271912} Si20 27 0.0 1 14 {} {0.0954622391458 0.229953977853 0.814997806795} Si21 28 0.0 1 8 {} {0.363494145291 0.589077631358 0.0463509056272} O5 29 0.0 1 1 {} {0.263064133872 0.593606774355 0.105669506401} H4 30 0.0 1 8 {} {0.128165103001 0.602250680508 0.77089460636} O6 31 0.0 1 1 {} {0.0631169490371 0.624065105874 0.715750529708} H5 32 0.0 1 8 {} {0.334149206273 0.177286479904 0.0410577769788} O7 33 0.0 1 1 {} {0.933270835243 0.173845009825 0.101136062806} H6 34 0.0 1 8 {} {0.0843478814437 0.179200637759 0.714237148214} O8 35 0.0 1 1 {} {0.183870780182 0.175605437572 0.654377623704} H7 36 0.0 1 14 {} {0.348994247152 0.307536130827 0.0630799729859} Si22 37 0.0 1 14 {} {0.349528505874 0.384821967711 0.443624536322} Si23 38 0.0 1 14 {} {0.599018362322 0.307713368693 0.192474727658} Si24 39 0.0 1 14 {} {0.600028697099 0.383750675323 0.318049370232} Si25 40 0.0 1 14 {} {0.3529401999 0.539845684413 0.432719314479} Si26 41 0.0 1 14 {} {0.607147167878 0.539530564794 0.310056902923} Si27 42 0.0 1 14 {} {0.352555849433 0.458854341546 0.0679968189206} Si28 43 0.0 1 14 {} {0.345155384944 0.229380841927 0.441821876143} Si29 44 0.0 1 14 {} {0.601164856028 0.45986236844 0.19663517846} Si30 45 0.0 1 14 {} {0.595277150107 0.229222687677 0.314082317689} Si31 46 0.0 1 8 {} {0.858827877517 0.593182653481 0.53224028731} O9 47 0.0 1 1 {} {0.946805091306 0.620904515391 0.525589526166} H8 48 0.0 1 8 {} {0.613678380713 0.591037055273 0.212016035226} O10 49 0.0 1 1 {} {0.51425709988 0.594201265448 0.150912616137} H9 50 0.0 1 8 {} {0.834097733359 0.178310103964 0.541096979674} O11 51 0.0 1 1 {} {0.433395374012 0.174658354274 0.600997997117} H10 52 0.0 1 8 {} {0.584386084678 0.17753049863 0.215916798714} O12 53 0.0 1 1 {} {0.683373601994 0.174017430331 0.155725310982} H11 54 0.0 1 14 {} {0.348662772125 0.307669932435 0.564872546127} Si32 55 0.0 1 14 {} {0.350300452353 0.384347007038 0.939794920166} Si33 56 0.0 1 14 {} {0.598965379439 0.308263871776 0.693274366831} Si34 57 0.0 1 14 {} {0.599693316993 0.386345774852 0.812141810553} Si35 58 0.0 1 14 {} {0.35058645699 0.536909663229 0.950498215878} Si36 59 0.0 1 14 {} {0.59870211575 0.539692735887 0.825218028074} Si37 60 0.0 1 14 {} {0.35071558165 0.463332052876 0.562945472654} Si38 61 0.0 1 14 {} {0.345384143328 0.228885468497 0.942642991406} Si39 62 0.0 1 14 {} {0.601070666316 0.464738016543 0.69126064185} Si40 63 0.0 1 14 {} {0.595308432748 0.229613682584 0.814916042049} Si41 64 0.0 1 8 {} {0.862441435413 0.589740662376 0.0437587330027} O13 65 0.0 1 1 {} {0.763469590238 0.593758041376 0.104286331451} H12 66 0.0 1 8 {} {0.592548066282 0.595375870066 0.742992488154} O14 67 0.0 1 14 {} {0.605247493753 0.659383830666 0.743094798349} Si42 68 0.0 1 8 {} {0.834257301925 0.177308342371 0.0409406773123} O15 69 0.0 1 1 {} {0.433232123353 0.173902544027 0.101205870862} H13 70 0.0 1 8 {} {0.584177226573 0.178722857196 0.714544499058} O16 71 0.0 1 1 {} {0.683568949195 0.175363945435 0.654480992879} H14 72 0.0 1 7 {} {0.464775758478 0.684947273443 0.629536150226} N 73 0.0 1 1 {} {0.436645806558 0.75010859643 0.651936304431} H16 74 0.0 1 9 {} {0.801339355104 0.67906258141 0.719352038234} F4 75 0.0 1 9 {} {0.315072396888 0.67634437821 0.381784525612} F5 76 0.0 1 9 {} {0.545538557696 0.681166184244 0.875433600222} F3 77 0.0 1 9 {} {0.122149476961 0.668186078372 0.573933871898} F1 78 0.0 1 9 {} {0.433464663749 0.788304005792 0.663891681732} F2 79 0.0 1 9 {} {0.583303741539 0.708849689176 0.506997782445} F6 80 0.0 1 @end @Columns Cell Constraints string {a b c A B G} Origin int {{0 0 0}} Parameters double {{10.0 10.0 10.0 90.0 90.0 90.0}} PrimitiveData double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} RotationMatrix double {{{1.0 0.0 0.0} {0.0 1.0 0.0} {0.0 0.0 1.0}}} SpaceGroup string P1 SpaceGroupNumber int 1 ToCartesians double {{{10.0 0.0 0.0} {0.0 10.0 0.0} {0.0 0.0 10.0}}} ToFractionals double {{{0.10000000000000001 0.0 0.0} {0.0 0.10000000000000001 0.0} {0.0 0.0 0.10000000000000001}}} @end @data {a b c A B G} {0 0 0} {7.6631 25.3262 10.83726 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{7.6631 0 0} {0 25.3262 0} {0 0 10.83726}} {{0.130495491381 0 0} {0 0.0394848022996 0} {0 0 0.0922742464424}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 70 63 0 0 45 38 0 0 21 19 0 0 78 73 0 0 58 42 0 0 3 1 0 0 27 20 0 0 22 6 0 0 56 54 0 0 37 3 0 0 60 26 0 1 62 24 0 1 17 16 0 0 54 43 0 0 45 43 0 0 27 25 0 0 26 21 0 0 40 10 0 0 44 6 0 0 77 11 0 0 61 36 0 0 38 0 0 0 2 0 0 0 57 19 0 0 13 12 0 0 25 0 0 0 47 46 0 0 75 11 0 0 62 60 0 1 24 1 0 0 18 7 0 0 54 37 0 0 29 28 0 0 57 56 0 0 56 18 0 0 58 28 0 0 42 8 0 0 39 38 0 0 67 66 0 0 66 59 0 0 3 2 0 0 57 55 0 0 19 0 0 0 61 27 0 0 63 25 0 0 49 48 0 0 54 20 0 0 68 33 0 0 44 39 0 0 62 57 0 0 68 25 0 0 8 6 0 0 53 52 0 0 52 45 0 0 45 7 0 0 72 11 0 0 50 7 0 0 72 67 0 0 35 34 0 0 48 41 0 0 11 10 0 0 8 5 0 0 39 1 0 0 61 32 0 0 51 14 0 0 50 15 0 0 21 20 0 0 63 61 0 0 55 42 0 0 38 36 0 0 31 30 0 0 26 24 0 1 65 64 0 0 43 9 0 0 76 67 0 0 18 1 0 0 8 3 0 0 9 7 0 0 55 21 0 0 19 6 0 0 44 42 0 0 36 2 0 0 63 56 0 0 71 70 0 0 16 9 0 0 9 2 0 0 69 32 0 0 39 37 0 0 64 22 0 0 34 27 0 0 20 18 0 0 55 36 0 0 43 14 0 0 46 4 0 0 30 23 0 0 60 37 0 0 12 5 0 0 74 67 0 0 @end @Columns Bond AsymmetricBond reference AsymmetricBond Atom1 reference Atom Atom2 reference Atom CellOffset2 int {{0 0 0}} Key int 0 @end @data 0 70 63 {0 0 0} 0 1 45 38 {0 0 0} 0 2 19 21 {1 0 0} 0 3 73 78 {0 0 0} 0 4 42 58 {0 0 -1} 0 5 3 1 {-1 0 0} 0 6 20 27 {0 0 0} 0 7 22 6 {0 0 1} 0 8 56 54 {0 0 0} 0 9 3 37 {0 0 0} 0 10 26 60 {0 0 0} 0 11 62 24 {0 0 0} 0 12 17 16 {0 0 0} 0 13 54 43 {0 0 0} 0 14 43 45 {0 0 0} 0 15 25 27 {1 0 0} 0 16 26 21 {0 0 0} 0 17 40 10 {0 0 0} 0 18 44 6 {0 0 0} 0 19 11 77 {0 0 0} 0 20 61 36 {0 0 1} 0 21 0 38 {0 0 0} 0 22 0 2 {1 0 0} 0 23 57 19 {0 0 0} 0 24 13 12 {0 0 0} 0 25 25 0 {0 0 1} 0 26 47 46 {0 0 0} 0 27 75 11 {0 0 0} 0 28 62 60 {0 0 0} 0 29 1 24 {0 0 0} 0 30 7 18 {0 0 0} 0 31 37 54 {0 0 0} 0 32 28 29 {0 0 0} 0 33 57 56 {0 0 0} 0 34 18 56 {0 0 0} 0 35 28 58 {0 0 -1} 0 36 8 42 {0 0 0} 0 37 38 39 {0 0 0} 0 38 67 66 {0 0 0} 0 39 59 66 {0 0 0} 0 40 3 2 {0 0 0} 0 41 57 55 {0 0 0} 0 42 0 19 {0 0 -1} 0 43 27 61 {0 0 0} 0 44 63 25 {0 0 0} 0 45 48 49 {0 0 0} 0 46 54 20 {0 0 0} 0 47 68 33 {0 0 0} 0 48 39 44 {0 0 0} 0 49 62 57 {0 0 0} 0 50 25 68 {0 0 1} 0 51 6 8 {1 0 0} 0 52 53 52 {0 0 0} 0 53 45 52 {0 0 0} 0 54 45 7 {0 0 0} 0 55 72 11 {0 0 0} 0 56 50 7 {0 0 0} 0 57 72 67 {0 0 0} 0 58 34 35 {0 0 0} 0 59 41 48 {0 0 0} 0 60 10 11 {0 0 0} 0 61 8 5 {0 0 0} 0 62 1 39 {0 0 0} 0 63 61 32 {0 0 1} 0 64 14 51 {0 0 0} 0 65 50 15 {0 0 0} 0 66 20 21 {0 0 0} 0 67 63 61 {0 0 0} 0 68 55 42 {0 0 1} 0 69 38 36 {0 0 0} 0 70 30 31 {0 0 0} 0 71 26 24 {-1 0 0} 0 72 64 65 {0 0 0} 0 73 9 43 {0 0 0} 0 74 76 67 {0 0 0} 0 75 1 18 {0 0 0} 0 76 8 3 {0 0 0} 0 77 7 9 {1 0 0} 0 78 55 21 {0 0 0} 0 79 19 6 {0 0 1} 0 80 44 42 {0 0 0} 0 81 36 2 {0 0 0} 0 82 56 63 {0 0 0} 0 83 70 71 {0 0 0} 0 84 16 9 {0 0 0} 0 85 2 9 {0 0 0} 0 86 69 32 {0 0 0} 0 87 39 37 {0 0 0} 0 88 22 64 {0 0 1} 0 89 27 34 {0 0 0} 0 90 20 18 {-1 0 0} 0 91 55 36 {0 0 1} 0 92 43 14 {0 0 0} 0 93 46 4 {0 0 0} 0 94 23 30 {0 0 0} 0 95 60 37 {0 0 0} 0 96 12 5 {0 0 0} 0 97 67 74 {0 0 0} 0 @end @Columns Subset Color string {{#65d9f0}} Criteria string {{}} DisplayLine int 0 IeqJ int 1 IgtJ int 0 IltJ int 0 Length int 1 Name string {{}} Table string {{}} Type string atom UseColor int 0 @end @data @end