#MD System 2.0 @Title neb0_image01 @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 {} {0.847842266723 0.306662012907 0.0634432155058} Si1 1 0.0 1 14 {} {0.848049102582 0.38503681766 0.444751809391} Si2 2 0.0 1 14 {} {0.0976982154822 0.306688966721 0.193185080156} Si3 3 0.0 1 14 {} {0.0979776348147 0.38293229665 0.318090443655} Si4 4 0.0 1 14 {} {0.853424861638 0.540683259285 0.434863726072} Si5 5 0.0 1 14 {} {0.103377601279 0.537188999003 0.308905274228} Si6 6 0.0 1 14 {} {0.849379574833 0.458048118954 0.0648768875645} Si7 7 0.0 1 14 {} {0.844270562309 0.228857318711 0.44195880739} Si8 8 0.0 1 14 {} {0.0991543171836 0.458202543351 0.193117298393} Si9 9 0.0 1 14 {} {0.0943010538285 0.228207529453 0.314235273885} Si10 10 0.0 1 8 {} {0.363876215947 0.593331626182 0.518021260018} O1 11 0.0 1 14 {} {0.345413228209 0.657249813898 0.521061645668} Si11 12 0.0 1 8 {} {0.111415980971 0.589541076452 0.212969264206} O2 13 0.0 1 1 {} {0.0116955256495 0.593048066652 0.152646969304} H1 14 0.0 1 8 {} {0.333439016512 0.177639110844 0.541582263756} O3 15 0.0 1 1 {} {0.932672941995 0.174519155374 0.601953161364} H2 16 0.0 1 8 {} {0.0832437168397 0.176554071885 0.216017324223} O4 17 0.0 1 1 {} {0.182249897093 0.173098026192 0.15584861743} H3 18 0.0 1 14 {} {0.847748697972 0.307311751783 0.564260992315} Si12 19 0.0 1 14 {} {0.849064732861 0.383031815417 0.938968931008} Si13 20 0.0 1 14 {} {0.0978544160812 0.307389972416 0.693073848382} Si14 21 0.0 1 14 {} {0.0989433614569 0.38530338979 0.812101722679} Si15 22 0.0 1 14 {} {0.849539030162 0.536864227417 0.94866314533} Si16 23 0.0 1 14 {} {0.0984819231053 0.540651331534 0.822506694167} Si17 24 0.0 1 14 {} {0.849747457045 0.463896827231 0.563093265361} Si18 25 0.0 1 14 {} {0.844217868511 0.22811065048 0.942719820302} Si19 26 0.0 1 14 {} {0.098653898369 0.464125917543 0.693299598425} Si20 27 0.0 1 14 {} {0.0942347725629 0.228868340217 0.815001329809} Si21 28 0.0 1 8 {} {0.360944945663 0.588577336793 0.0460967187371} O5 29 0.0 1 1 {} {0.261345887269 0.593140779863 0.106034014475} H4 30 0.0 1 8 {} {0.11296544463 0.596280073305 0.742147879647} O6 31 0.0 1 1 {} {0.0153940213152 0.621521495109 0.740289099683} H5 32 0.0 1 8 {} {0.333198136491 0.176436483309 0.0410922346471} O7 33 0.0 1 1 {} {0.93234762422 0.173161745927 0.101372776349} H6 34 0.0 1 8 {} {0.0834346049345 0.177862237999 0.714963205606} O8 35 0.0 1 1 {} {0.182775656684 0.174534862529 0.654871908881} H7 36 0.0 1 14 {} {0.347645671101 0.306615459203 0.0634667772222} Si22 37 0.0 1 14 {} {0.348344030783 0.38491193982 0.444457736518} Si23 38 0.0 1 14 {} {0.597741307664 0.306557234896 0.19298061556} Si24 39 0.0 1 14 {} {0.598430066749 0.382775794944 0.317779935723} Si25 40 0.0 1 14 {} {0.355610063182 0.539003880284 0.4330192661} Si26 41 0.0 1 14 {} {0.605218292803 0.536914249166 0.307317344519} Si27 42 0.0 1 14 {} {0.348714373477 0.457877038335 0.065570471128} Si28 43 0.0 1 14 {} {0.344424535935 0.228771974151 0.441913659154} Si29 44 0.0 1 14 {} {0.599643492262 0.457947940297 0.192411296939} Si30 45 0.0 1 14 {} {0.594361530315 0.228101379103 0.314042397172} Si31 46 0.0 1 8 {} {0.84279267985 0.595737546203 0.517417643999} O9 47 0.0 1 1 {} {0.939857703235 0.620852447627 0.51824790724} H8 48 0.0 1 8 {} {0.613558226861 0.58882880693 0.210556347579} O10 49 0.0 1 1 {} {0.51244658885 0.5928313222 0.151457998789} H9 50 0.0 1 8 {} {0.833384273507 0.17778190812 0.541777271174} O11 51 0.0 1 1 {} {0.432651587951 0.174368829813 0.601797632502} H10 52 0.0 1 8 {} {0.583410038428 0.17641326324 0.21591519694} O12 53 0.0 1 1 {} {0.682340370773 0.173010384134 0.155659617894} H11 54 0.0 1 14 {} {0.347938455219 0.307225676633 0.564251269122} Si32 55 0.0 1 14 {} {0.348468035882 0.3830218602 0.939229359397} Si33 56 0.0 1 14 {} {0.597850186816 0.30740377135 0.693276666571} Si34 57 0.0 1 14 {} {0.598739171478 0.385224794045 0.812628463427} Si35 58 0.0 1 14 {} {0.347173346066 0.53654543302 0.950006242472} Si36 59 0.0 1 14 {} {0.596625122385 0.538909365626 0.824614997174} Si37 60 0.0 1 14 {} {0.349071435246 0.463475065885 0.563864244873} Si38 61 0.0 1 14 {} {0.344076489515 0.228060872454 0.942806671286} Si39 62 0.0 1 14 {} {0.599574199253 0.463639173864 0.692682945304} Si40 63 0.0 1 14 {} {0.594139681341 0.228861971525 0.815131996427} Si41 64 0.0 1 8 {} {0.861906567145 0.589170994821 0.0443973072408} O13 65 0.0 1 1 {} {0.76196277471 0.593211163969 0.104715136297} H12 66 0.0 1 8 {} {0.591594351902 0.593966795582 0.742765252867} O14 67 0.0 1 14 {} {0.60446376792 0.657974887747 0.741076637155} Si42 68 0.0 1 8 {} {0.833439052793 0.176508787435 0.0410666897617} O15 69 0.0 1 1 {} {0.432224350471 0.173018865379 0.101267785638} H13 70 0.0 1 8 {} {0.583367357796 0.17788346816 0.715027384561} O16 71 0.0 1 1 {} {0.682720776515 0.174608225507 0.654917622615} H14 72 0.0 1 7 {} {0.469121309087 0.684037386116 0.633860743557} N 73 0.0 1 1 {} {0.458137487212 0.724809329595 0.640068227197} H16 74 0.0 1 9 {} {0.807601281899 0.672222080803 0.721567713112} F4 75 0.0 1 9 {} {0.391165606185 0.680092674876 0.387779198705} F5 76 0.0 1 9 {} {0.562093436447 0.681128891625 0.874736619092} F3 77 0.0 1 9 {} {0.140243466158 0.670686201435 0.537157371208} F1 78 0.0 1 9 {} {0.423138121965 0.793434010021 0.666531226446} F2 79 0.0 1 9 {} {0.578257812273 0.79545311541 0.56494892684} 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 58 42 0 0 3 1 0 0 73 72 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 2 0 0 0 38 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 79 78 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 44 41 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 42 58 {0 0 -1} 0 4 3 1 {-1 0 0} 0 5 72 73 {0 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 2 {1 0 0} 0 22 0 38 {0 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 78 79 {0 0 0} 0 68 63 61 {0 0 0} 0 69 55 42 {0 0 1} 0 70 38 36 {0 0 0} 0 71 30 31 {0 0 0} 0 72 26 24 {-1 0 0} 0 73 64 65 {0 0 0} 0 74 9 43 {0 0 0} 0 75 76 67 {0 0 0} 0 76 1 18 {0 0 0} 0 77 8 3 {0 0 0} 0 78 7 9 {1 0 0} 0 79 55 21 {0 0 0} 0 80 19 6 {0 0 1} 0 81 44 42 {0 0 0} 0 82 36 2 {0 0 0} 0 83 56 63 {0 0 0} 0 84 41 44 {0 0 0} 0 85 70 71 {0 0 0} 0 86 16 9 {0 0 0} 0 87 2 9 {0 0 0} 0 88 69 32 {0 0 0} 0 89 39 37 {0 0 0} 0 90 22 64 {0 0 1} 0 91 27 34 {0 0 0} 0 92 20 18 {-1 0 0} 0 93 55 36 {0 0 1} 0 94 43 14 {0 0 0} 0 95 46 4 {0 0 0} 0 96 23 30 {0 0 0} 0 97 60 37 {0 0 0} 0 98 12 5 {0 0 0} 0 99 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