#MD System 2.0 @Title neb0_image09 @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 {} {0.849587724539 0.308095115051 0.0622895705345} Si1 1 0.0 1 14 {} {0.850291221035 0.385398908507 0.444215110886} Si2 2 0.0 1 14 {} {0.0995246054291 0.307751446352 0.192302762296} Si3 3 0.0 1 14 {} {0.099792032298 0.383671207968 0.317596082358} Si4 4 0.0 1 14 {} {0.860712023909 0.54316095354 0.439627994126} Si5 5 0.0 1 14 {} {0.10297445269 0.537724343138 0.304528011481} Si6 6 0.0 1 14 {} {0.84675655885 0.459292195519 0.0667844565532} Si7 7 0.0 1 14 {} {0.845985599161 0.230154416189 0.442250376285} Si8 8 0.0 1 14 {} {0.0992803784509 0.458699961855 0.191859844407} Si9 9 0.0 1 14 {} {0.0956980514156 0.229351554937 0.313597929065} Si10 10 0.0 1 8 {} {0.320286846147 0.589534409511 0.530381753469} O1 11 0.0 1 14 {} {0.344750059343 0.656255738805 0.520283405117} Si11 12 0.0 1 8 {} {0.113228464505 0.589658372316 0.208246623684} O2 13 0.0 1 1 {} {0.0131762206 0.594466716881 0.148566048751} H1 14 0.0 1 8 {} {0.334855114072 0.178107648654 0.540202088898} O3 15 0.0 1 1 {} {0.933727997044 0.175398082944 0.600905302179} H2 16 0.0 1 8 {} {0.0845812397055 0.177586755726 0.21593901651} O4 17 0.0 1 1 {} {0.183553222287 0.174041441704 0.155811866786} H3 18 0.0 1 14 {} {0.850350488935 0.308392233615 0.565141951521} Si12 19 0.0 1 14 {} {0.849392726506 0.384874930934 0.938934270356} Si13 20 0.0 1 14 {} {0.0998965169453 0.309801858787 0.694892971547} Si14 21 0.0 1 14 {} {0.100837355592 0.388513688118 0.813238427283} Si15 22 0.0 1 14 {} {0.852883215608 0.537739577826 0.950788952857} Si16 23 0.0 1 14 {} {0.104433768889 0.542543164552 0.82084073026} Si17 24 0.0 1 14 {} {0.851561218956 0.464512409034 0.56000784197} Si18 25 0.0 1 14 {} {0.845977701449 0.229393145684 0.942472283718} Si19 26 0.0 1 14 {} {0.101483581372 0.466706439075 0.690200035054} Si20 27 0.0 1 14 {} {0.0961576900049 0.230642625326 0.814930400488} Si21 28 0.0 1 8 {} {0.363695910845 0.58968720305 0.0467362195432} O5 29 0.0 1 1 {} {0.263426026057 0.59424170936 0.107153150703} H4 30 0.0 1 8 {} {0.109417674256 0.603858278442 0.781176962483} O6 31 0.0 1 1 {} {0.108347438497 0.627445085557 0.705736846093} H5 32 0.0 1 8 {} {0.334920120458 0.1779355292 0.0410468531481} O7 33 0.0 1 1 {} {0.933873641221 0.174254670184 0.10099004696} H6 34 0.0 1 8 {} {0.0851106869742 0.180136345087 0.713807027638} O8 35 0.0 1 1 {} {0.184602426097 0.176251044458 0.654042419875} H7 36 0.0 1 14 {} {0.349708812253 0.308135215948 0.0624584479023} Si22 37 0.0 1 14 {} {0.35041497011 0.384649351919 0.443345418364} Si23 38 0.0 1 14 {} {0.599738943051 0.308372940701 0.192332760535} Si24 39 0.0 1 14 {} {0.600821956546 0.384406284785 0.31784445364} Si25 40 0.0 1 14 {} {0.34886081754 0.539832859816 0.435591152039} Si26 41 0.0 1 14 {} {0.606487380123 0.543323501053 0.314224148967} Si27 42 0.0 1 14 {} {0.354665569381 0.459019911573 0.0692589253095} Si28 43 0.0 1 14 {} {0.345496542275 0.229744261527 0.442139449862} Si29 44 0.0 1 14 {} {0.602305091073 0.462065545067 0.200992143833} Si30 45 0.0 1 14 {} {0.595803248442 0.229927054124 0.313894023848} Si31 46 0.0 1 8 {} {0.874586604543 0.591083014125 0.541095110667} O9 47 0.0 1 1 {} {0.954349672445 0.621609671903 0.536770908027} H8 48 0.0 1 8 {} {0.618067488252 0.591367570126 0.208009351616} O10 49 0.0 1 1 {} {0.515450431713 0.595876727126 0.150289396642} H9 50 0.0 1 8 {} {0.834583821867 0.178669840019 0.540703330882} O11 51 0.0 1 1 {} {0.433801169332 0.174772419686 0.600508383705} H10 52 0.0 1 8 {} {0.58506198224 0.178268811589 0.215905953947} O12 53 0.0 1 1 {} {0.684049063309 0.174618151228 0.155811259126} H11 54 0.0 1 14 {} {0.349070385324 0.307881974719 0.564881595103} Si32 55 0.0 1 14 {} {0.351702751772 0.385028237732 0.939594999441} Si33 56 0.0 1 14 {} {0.599560651247 0.308843638013 0.693499715558} Si34 57 0.0 1 14 {} {0.600455760777 0.387023365466 0.811860490441} Si35 58 0.0 1 14 {} {0.35453466373 0.537223973896 0.953683535812} Si36 59 0.0 1 14 {} {0.601155061198 0.541735836012 0.818439824213} Si37 60 0.0 1 14 {} {0.35160529052 0.463076201049 0.560406710918} Si38 61 0.0 1 14 {} {0.346207945152 0.229425870247 0.942658376556} Si39 62 0.0 1 14 {} {0.601601414431 0.465122507158 0.690367102817} Si40 63 0.0 1 14 {} {0.595993415075 0.230139840077 0.814614976058} Si41 64 0.0 1 8 {} {0.861989172384 0.59032997186 0.0435582560455} O13 65 0.0 1 1 {} {0.763322446908 0.594369254284 0.105734870177} H12 66 0.0 1 8 {} {0.595549607087 0.597211901072 0.742723749712} O14 67 0.0 1 14 {} {0.59325647187 0.662641683645 0.741855623781} Si42 68 0.0 1 8 {} {0.834902935086 0.17790589065 0.0408661939808} O15 69 0.0 1 1 {} {0.433931097639 0.17441956457 0.101165724077} H13 70 0.0 1 8 {} {0.584776416578 0.17935985853 0.714257280395} O16 71 0.0 1 1 {} {0.684089156278 0.175822673433 0.654228857835} H14 72 0.0 1 7 {} {0.45316981079 0.688115641199 0.638296136958} N 73 0.0 1 1 {} {0.441604598986 0.752982423519 0.646822984055} H16 74 0.0 1 9 {} {0.789832872779 0.680887781996 0.721799168715} F4 75 0.0 1 9 {} {0.270618578106 0.682781857603 0.394170601755} F5 76 0.0 1 9 {} {0.539688653393 0.680231830783 0.878046436165} F3 77 0.0 1 9 {} {0.140512142386 0.662832994885 0.587467342891} F1 78 0.0 1 9 {} {0.436810410545 0.789633215265 0.661903366153} F2 79 0.0 1 9 {} {0.550717409059 0.658383981988 0.452647164143} 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