#MD System 2.0 @Title neb0_image08 @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 {} {0.849337624748 0.307613693535 0.0629534999457} Si1 1 0.0 1 14 {} {0.85002735504 0.385108309339 0.444450899145} Si2 2 0.0 1 14 {} {0.0992443849106 0.307418346194 0.192734323465} Si3 3 0.0 1 14 {} {0.0994237811127 0.383394937371 0.317894391519} Si4 4 0.0 1 14 {} {0.858297463418 0.542032950094 0.43853259858} Si5 5 0.0 1 14 {} {0.106236503157 0.53851976707 0.307668185478} Si6 6 0.0 1 14 {} {0.850566393547 0.458531401169 0.0660369636291} Si7 7 0.0 1 14 {} {0.845542319941 0.229692362743 0.442147327805} Si8 8 0.0 1 14 {} {0.100596296698 0.458823422288 0.194094565314} Si9 9 0.0 1 14 {} {0.0953547699771 0.228971180886 0.313773193136} Si10 10 0.0 1 8 {} {0.369516986697 0.595076384945 0.516360701422} O1 11 0.0 1 14 {} {0.348080165126 0.663791581146 0.517317667276} Si11 12 0.0 1 8 {} {0.112085836798 0.589331243813 0.2090988273} O2 13 0.0 1 1 {} {0.0117351442065 0.593822473975 0.14953565148} H1 14 0.0 1 8 {} {0.334679618926 0.178232097251 0.540658283342} O3 15 0.0 1 1 {} {0.93352002245 0.175115362024 0.601191553897} H2 16 0.0 1 8 {} {0.084319998254 0.177278367946 0.215935688834} O4 17 0.0 1 1 {} {0.183242990627 0.173712422515 0.155804502448} H3 18 0.0 1 14 {} {0.849657483019 0.307963329557 0.565024169478} Si12 19 0.0 1 14 {} {0.849786612853 0.384122986901 0.938828247587} Si13 20 0.0 1 14 {} {0.0996281723329 0.309114799203 0.694081603392} Si14 21 0.0 1 14 {} {0.100376036829 0.387705995838 0.812700663464} Si15 22 0.0 1 14 {} {0.850782248889 0.53723656327 0.950823947561} Si16 23 0.0 1 14 {} {0.10160582077 0.543824924317 0.822188862656} Si17 24 0.0 1 14 {} {0.850827471708 0.463943996704 0.561722256513} Si18 25 0.0 1 14 {} {0.84554336811 0.228975150421 0.942608636315} Si19 26 0.0 1 14 {} {0.100365877689 0.466730338733 0.691750827165} Si20 27 0.0 1 14 {} {0.0957153952934 0.230053318839 0.815004320106} Si21 28 0.0 1 8 {} {0.364343649821 0.588783233504 0.0469233628962} O5 29 0.0 1 1 {} {0.263840546075 0.594077434736 0.106020516377} H4 30 0.0 1 8 {} {0.123159690255 0.602965104048 0.780581065656} O6 31 0.0 1 1 {} {0.0898362386503 0.623958858348 0.70278168755} H5 32 0.0 1 8 {} {0.334492509813 0.177488447046 0.0410817279748} O7 33 0.0 1 1 {} {0.933491758249 0.173849152976 0.101035338171} H6 34 0.0 1 8 {} {0.0846018527306 0.179484815795 0.714031446024} O8 35 0.0 1 1 {} {0.184110266702 0.175700121219 0.654271621775} H7 36 0.0 1 14 {} {0.349176845131 0.307693741694 0.062928469273} Si22 37 0.0 1 14 {} {0.349201822619 0.386333698034 0.444663433612} Si23 38 0.0 1 14 {} {0.599234493625 0.307729376905 0.192585339053} Si24 39 0.0 1 14 {} {0.599823031015 0.383626261029 0.318524250456} Si25 40 0.0 1 14 {} {0.3579462249 0.541643198242 0.432071811424} Si26 41 0.0 1 14 {} {0.608200291811 0.539365252515 0.308218474839} Si27 42 0.0 1 14 {} {0.351726910213 0.458460805641 0.0679034266384} Si28 43 0.0 1 14 {} {0.345420001845 0.229640187213 0.441927493197} Si29 44 0.0 1 14 {} {0.602365694172 0.459383669513 0.195447998322} Si30 45 0.0 1 14 {} {0.595543893652 0.229331581093 0.313862724783} Si31 46 0.0 1 8 {} {0.868803799976 0.591528549252 0.534986586649} O9 47 0.0 1 1 {} {0.944257611486 0.622709503535 0.522896316846} H8 48 0.0 1 8 {} {0.615153941613 0.590983862034 0.212004028894} O10 49 0.0 1 1 {} {0.513956839667 0.59485744959 0.153081449844} H9 50 0.0 1 8 {} {0.834404705026 0.178351374156 0.54095421646} O11 51 0.0 1 1 {} {0.43375316232 0.174693934541 0.600795107203} H10 52 0.0 1 8 {} {0.584683696812 0.177717999853 0.215838003979} O12 53 0.0 1 1 {} {0.683611431828 0.174119290393 0.15572862451} H11 54 0.0 1 14 {} {0.34908506708 0.308339764477 0.564437371985} Si32 55 0.0 1 14 {} {0.350209085484 0.384377283809 0.939520039439} Si33 56 0.0 1 14 {} {0.599192399707 0.308416045472 0.693551798142} Si34 57 0.0 1 14 {} {0.599638690609 0.38638187416 0.812767545946} Si35 58 0.0 1 14 {} {0.35113748336 0.536795940926 0.952565992256} Si36 59 0.0 1 14 {} {0.599576384783 0.540680931809 0.821506623753} Si37 60 0.0 1 14 {} {0.35058885154 0.466098943797 0.560760063692} Si38 61 0.0 1 14 {} {0.345772103493 0.228951003796 0.942707498711} Si39 62 0.0 1 14 {} {0.600184977371 0.464742390344 0.691497687381} Si40 63 0.0 1 14 {} {0.595561831473 0.229681864829 0.8147107752} Si41 64 0.0 1 8 {} {0.86091839514 0.58963144727 0.0447064841775} O13 65 0.0 1 1 {} {0.76166885893 0.594683633411 0.105165515771} H12 66 0.0 1 8 {} {0.59789259482 0.596253826238 0.746575064939} O14 67 0.0 1 14 {} {0.588965575313 0.661194729946 0.748979343785} Si42 68 0.0 1 8 {} {0.834583440143 0.17749011932 0.0409103448395} O15 69 0.0 1 1 {} {0.433419835851 0.17396554612 0.101225996941} H13 70 0.0 1 8 {} {0.584535992774 0.178870739414 0.714453009336} O16 71 0.0 1 1 {} {0.683799224615 0.175338480486 0.654418608943} H14 72 0.0 1 7 {} {0.434756247434 0.689267009982 0.656552619073} N 73 0.0 1 1 {} {0.434489143364 0.753227088459 0.660875929058} H16 74 0.0 1 9 {} {0.783763198779 0.679441241889 0.717535393335} F4 75 0.0 1 9 {} {0.273720401079 0.680812821024 0.380279474846} F5 76 0.0 1 9 {} {0.553663318026 0.678527610568 0.88920975409} F3 77 0.0 1 9 {} {0.143511637869 0.66386549483 0.573999353762} F1 78 0.0 1 9 {} {0.436308045001 0.791077596024 0.657805248483} F2 79 0.0 1 9 {} {0.557862905076 0.675706267874 0.465466949553} 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 79 11 0 0 45 38 0 0 21 19 0 0 78 73 0 0 3 1 0 0 27 20 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 1 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 1 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 11 79 {0 0 0} 0 2 45 38 {0 0 0} 0 3 19 21 {1 0 0} 0 4 73 78 {0 0 0} 0 5 3 1 {-1 0 0} 0 6 20 27 {0 0 0} 0 7 56 54 {0 0 0} 0 8 3 37 {0 0 0} 0 9 26 60 {0 0 0} 0 10 62 24 {0 0 0} 0 11 17 16 {0 0 0} 0 12 54 43 {0 0 0} 0 13 43 45 {0 0 0} 0 14 25 27 {1 0 0} 0 15 26 21 {0 0 0} 0 16 40 10 {0 0 0} 0 17 44 6 {0 0 0} 0 18 11 77 {0 0 0} 0 19 61 36 {0 0 1} 0 20 0 38 {0 0 0} 0 21 0 2 {1 0 0} 0 22 57 19 {0 0 0} 0 23 13 12 {0 0 0} 0 24 25 0 {0 0 1} 0 25 47 46 {0 0 0} 0 26 75 11 {0 0 0} 0 27 62 60 {0 0 0} 0 28 1 24 {0 0 0} 0 29 7 18 {0 0 0} 0 30 37 54 {0 0 0} 0 31 28 29 {0 0 0} 0 32 57 56 {0 0 0} 0 33 18 56 {0 0 0} 0 34 28 58 {0 0 -1} 0 35 8 42 {0 0 0} 0 36 38 39 {0 0 0} 0 37 67 66 {0 0 0} 0 38 59 66 {0 0 0} 0 39 3 2 {0 0 0} 0 40 57 55 {0 0 0} 0 41 0 19 {0 0 -1} 0 42 27 61 {0 0 0} 0 43 63 25 {0 0 0} 0 44 48 49 {0 0 0} 0 45 54 20 {0 0 0} 0 46 33 68 {0 0 0} 0 47 39 44 {0 0 0} 0 48 62 57 {0 0 0} 0 49 25 68 {0 0 1} 0 50 6 8 {1 0 0} 0 51 53 52 {0 0 0} 0 52 45 52 {0 0 0} 0 53 45 7 {0 0 0} 0 54 72 11 {0 0 0} 0 55 50 7 {0 0 0} 0 56 72 67 {0 0 0} 0 57 34 35 {0 0 0} 0 58 41 48 {0 0 0} 0 59 10 11 {0 0 0} 0 60 8 5 {0 0 0} 0 61 1 39 {0 0 0} 0 62 61 32 {0 0 1} 0 63 14 51 {0 0 0} 0 64 50 15 {0 0 0} 0 65 20 21 {0 0 0} 0 66 63 61 {0 0 0} 0 67 55 42 {0 0 1} 0 68 38 36 {0 0 0} 0 69 30 31 {0 0 0} 0 70 26 24 {-1 0 0} 0 71 64 65 {0 0 0} 0 72 9 43 {0 0 0} 0 73 76 67 {0 0 0} 0 74 1 18 {0 0 0} 0 75 8 3 {0 0 0} 0 76 7 9 {1 0 0} 0 77 55 21 {0 0 0} 0 78 19 6 {0 0 1} 0 79 44 42 {0 0 0} 0 80 36 2 {0 0 0} 0 81 56 63 {0 0 0} 0 82 70 71 {0 0 0} 0 83 16 9 {0 0 0} 0 84 2 9 {0 0 0} 0 85 69 32 {0 0 0} 0 86 39 37 {0 0 0} 0 87 22 64 {0 0 1} 0 88 27 34 {0 0 0} 0 89 20 18 {-1 0 0} 0 90 55 36 {0 0 1} 0 91 43 14 {0 0 0} 0 92 46 4 {0 0 0} 0 93 23 30 {0 0 0} 0 94 60 37 {0 0 0} 0 95 12 5 {0 0 0} 0 96 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