#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 {} {0.849674146724 0.30787956199 0.0626252963764} Si1 1 0.0 1 14 {} {0.850215536271 0.385211857769 0.44446535928} Si2 2 0.0 1 14 {} {0.0995983655852 0.307600447902 0.19270875404} Si3 3 0.0 1 14 {} {0.0999771712894 0.383576999504 0.318071235964} Si4 4 0.0 1 14 {} {0.861067134219 0.542512916936 0.439417824246} Si5 5 0.0 1 14 {} {0.104494666782 0.537952923941 0.304895302075} Si6 6 0.0 1 14 {} {0.849203893651 0.458858865767 0.0659015221245} Si7 7 0.0 1 14 {} {0.845902637314 0.229925911836 0.442302793027} Si8 8 0.0 1 14 {} {0.0999671327864 0.458732254172 0.193101625136} Si9 9 0.0 1 14 {} {0.0956651851509 0.229153938529 0.313671404639} Si10 10 0.0 1 8 {} {0.339190178025 0.592020068463 0.524994406156} O1 11 0.0 1 14 {} {0.353204570728 0.659178082188 0.516942579536} Si11 12 0.0 1 8 {} {0.112854008833 0.589567264966 0.208304209358} O2 13 0.0 1 1 {} {0.0122804751437 0.594221865155 0.14904815322} H1 14 0.0 1 8 {} {0.334895837332 0.178285441044 0.540445083198} O3 15 0.0 1 1 {} {0.933792250826 0.175253341269 0.601024921283} H2 16 0.0 1 8 {} {0.0846131688387 0.177424492672 0.215924702727} O4 17 0.0 1 1 {} {0.183607795173 0.173851602983 0.155808317863} H3 18 0.0 1 14 {} {0.850092518604 0.30814255339 0.565186068311} Si12 19 0.0 1 14 {} {0.849976156551 0.384454230758 0.938530458807} Si13 20 0.0 1 14 {} {0.100050849856 0.309575893779 0.694545638493} Si14 21 0.0 1 14 {} {0.100798449362 0.38829046737 0.812482460289} Si15 22 0.0 1 14 {} {0.851983384923 0.537708485448 0.951228630219} Si16 23 0.0 1 14 {} {0.103294951952 0.543394540615 0.820881841711} Si17 24 0.0 1 14 {} {0.851184333008 0.464284505875 0.560758551305} Si18 25 0.0 1 14 {} {0.846019892931 0.22923958483 0.942603506033} Si19 26 0.0 1 14 {} {0.101405770956 0.466977223839 0.690678213183} Si20 27 0.0 1 14 {} {0.0962748375436 0.230445694539 0.814931892284} Si21 28 0.0 1 8 {} {0.364045269902 0.589246268119 0.0470290915153} O5 29 0.0 1 1 {} {0.263558851173 0.594208379643 0.106751164322} H4 30 0.0 1 8 {} {0.110469045252 0.604621786543 0.779426702792} O6 31 0.0 1 1 {} {0.112944153935 0.625645813137 0.701318463493} H5 32 0.0 1 8 {} {0.334866516404 0.177729013835 0.0410840863434} O7 33 0.0 1 1 {} {0.933895342641 0.174026275957 0.100959360427} H6 34 0.0 1 8 {} {0.0849610186506 0.179900458589 0.713917656638} O8 35 0.0 1 1 {} {0.184513377064 0.176007804216 0.65421345078} H7 36 0.0 1 14 {} {0.349498077732 0.307896680096 0.0626806839492} Si22 37 0.0 1 14 {} {0.349996263754 0.385531108968 0.444402507084} Si23 38 0.0 1 14 {} {0.599554359823 0.308045219181 0.192619503141} Si24 39 0.0 1 14 {} {0.600238028451 0.383971750384 0.318478460651} Si25 40 0.0 1 14 {} {0.353814909128 0.541234811058 0.434729940341} Si26 41 0.0 1 14 {} {0.609232616402 0.541221573081 0.310349653745} Si27 42 0.0 1 14 {} {0.353243278384 0.458733946088 0.0684498093918} Si28 43 0.0 1 14 {} {0.345573790111 0.229827297333 0.442141021534} Si29 44 0.0 1 14 {} {0.603076487575 0.46053180305 0.197815393312} Si30 45 0.0 1 14 {} {0.595792436389 0.229591233375 0.313879907527} Si31 46 0.0 1 8 {} {0.875475309792 0.590677840276 0.539155166987} O9 47 0.0 1 1 {} {0.948508931997 0.622657676037 0.529711078707} H8 48 0.0 1 8 {} {0.617221431787 0.591258710498 0.209556803379} O10 49 0.0 1 1 {} {0.514587888088 0.595659220819 0.152012496962} H9 50 0.0 1 8 {} {0.83465335293 0.178453595612 0.540782571473} O11 51 0.0 1 1 {} {0.433997635359 0.174757274405 0.600558886424} H10 52 0.0 1 8 {} {0.585007694428 0.177957275355 0.215835280165} O12 53 0.0 1 1 {} {0.684011934226 0.174355439741 0.155719652016} H11 54 0.0 1 14 {} {0.349178842653 0.308243081014 0.564426347669} Si32 55 0.0 1 14 {} {0.350656587096 0.384671714652 0.939597731381} Si33 56 0.0 1 14 {} {0.599253977311 0.308701835969 0.693558115492} Si34 57 0.0 1 14 {} {0.599897806589 0.386830331102 0.812300795738} Si35 58 0.0 1 14 {} {0.353605269019 0.537001324144 0.953550148736} Si36 59 0.0 1 14 {} {0.600481981435 0.541599480078 0.819138004054} Si37 60 0.0 1 14 {} {0.351349221505 0.46438969864 0.560419540633} Si38 61 0.0 1 14 {} {0.346227162346 0.229234412346 0.942762167058} Si39 62 0.0 1 14 {} {0.600897059525 0.465121041354 0.691021455558} Si40 63 0.0 1 14 {} {0.595993816913 0.229953953524 0.814592318604} Si41 64 0.0 1 8 {} {0.861187267688 0.590052093304 0.0445926972836} O13 65 0.0 1 1 {} {0.761870288005 0.594760914794 0.105805926787} H12 66 0.0 1 8 {} {0.592976426941 0.597264862601 0.744664653054} O14 67 0.0 1 14 {} {0.587352818586 0.663062033549 0.746102738395} Si42 68 0.0 1 8 {} {0.834876326062 0.17772002435 0.0408952193176} O15 69 0.0 1 1 {} {0.433863328859 0.174182900087 0.101214850685} H13 70 0.0 1 8 {} {0.584861391915 0.17912750411 0.714356015667} O16 71 0.0 1 1 {} {0.684166661113 0.175527106439 0.654337719164} H14 72 0.0 1 7 {} {0.440984169661 0.688960239027 0.646755889445} N 73 0.0 1 1 {} {0.435110264269 0.753896582563 0.655605002186} H16 74 0.0 1 9 {} {0.782918230567 0.681266576911 0.718284166954} F4 75 0.0 1 9 {} {0.26637925803 0.683524829802 0.393320254388} F5 76 0.0 1 9 {} {0.547409458647 0.678772901289 0.886455006195} F3 77 0.0 1 9 {} {0.140714846101 0.661175563874 0.584795309731} F1 78 0.0 1 9 {} {0.437040850345 0.792014801801 0.659008268688} F2 79 0.0 1 9 {} {0.552766049672 0.659909216171 0.4516315124} 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