#MD System 2.0 @Title neb0_image10 @Columns AsymmetricAtom AtomicNumber int 0 Connections string {{}} Fractional double {{0.0 0.0 0.0}} Freeze int 0 Name string {{}} Site int 1 Spin double 0.0 WyckoffPosition int -1 @end @data 14 {} {0.120874592067 0.132044603191 0.386363722432} 7 Si1 1 0.0 1 14 {} {0.366543742067 0.125943153191 0.307499462432} 7 Si2 2 0.0 1 14 {} {0.304606394691 0.0897505573771 0.609562144799} 0 Si3 3 0.0 1 14 {} {0.0932538020675 0.399488073191 0.150024212432} 7 Si4 4 0.0 1 14 {} {0.0862496420675 0.383942173191 0.462915112432} 7 Si5 5 0.0 1 14 {} {0.344293062067 0.372830073191 0.228977402432} 7 Si6 6 0.0 1 14 {} {0.339521495144 0.351461964949 0.537297942182} 0 Si7 7 0.0 1 8 {} {0.0642964220675 0.019201413191 0.103701352432} 7 O1 8 0.0 1 8 {} {0.0742109920675 0.032720133191 0.438837652432} 7 O2 9 0.0 1 8 {} {0.294182612067 0.244741373191 0.268763692432} 7 O3 10 0.0 1 8 {} {0.309459182182 0.188971664027 0.553086729818} 0 O4 11 0.0 1 8 {} {0.147126312067 0.272660653191 0.107950542432} 7 O5 12 0.0 1 8 {} {0.148896052067 0.280554263191 0.415338692432} 7 O6 13 0.0 1 8 {} {0.410882632067 0.493560783191 0.268241112432} 7 O7 14 0.0 1 8 {} {0.352423235884 0.442413059061 0.595700170396} 0 O8 15 0.0 1 8 {} {0.457894382067 0.312907493191 0.184441022432} 7 O9 16 0.0 1 8 {} {0.441153602067 0.378918103191 0.481010312432} 7 O10 17 0.0 1 8 {} {0.215427642067 0.439491423191 0.194756022432} 7 O11 18 0.0 1 8 {} {0.189977565927 0.405536275378 0.514940846211} 0 O12 19 0.0 1 8 {} {0.260052182067 0.074241863191 0.356649442432} 7 O13 20 0.0 1 8 {} {0.150630401084 0.0771342117412 0.636617526467} 0 O14 21 0.0 1 8 {} {0.00672573206749 0.148682823191 0.336481502432} 7 O15 22 0.0 1 8 {} {0.895595563754 0.231735763855 0.657270155372} 0 O16 23 0.0 1 14 {} {0.121679902067 0.633169063191 0.382321852432} 7 Si8 24 0.0 1 14 {} {0.372436582067 0.626239053191 0.307009972432} 7 Si9 25 0.0 1 14 {} {0.317015575839 0.598978017291 0.613739592428} 0 Si10 26 0.0 1 14 {} {0.106340462067 0.898002753191 0.146931222432} 7 Si11 27 0.0 1 14 {} {0.0811117520675 0.877974283191 0.463911852432} 7 Si12 28 0.0 1 14 {} {0.352444492067 0.873733803191 0.228842742432} 7 Si13 29 0.0 1 14 {} {0.338188466793 0.841593557665 0.538564963813} 0 Si14 30 0.0 1 8 {} {0.0435008020675 0.524319993191 0.110064562432} 7 O17 31 0.0 1 8 {} {0.0636122120675 0.531075943191 0.431622152432} 7 O18 32 0.0 1 8 {} {0.301035492067 0.746140563191 0.268587232432} 7 O19 33 0.0 1 8 {} {0.37326320272 0.687930933246 0.559273305469} 0 O20 34 0.0 1 8 {} {0.158514482067 0.766601963191 0.107009082432} 7 O21 35 0.0 1 8 {} {0.136757472067 0.782274253191 0.412480222432} 7 O22 36 0.0 1 8 {} {0.414467022067 0.996232093191 0.268654792432} 7 O23 37 0.0 1 8 {} {0.370620798198 0.942494413391 0.592356896839} 0 O24 38 0.0 1 8 {} {0.469312102067 0.813387373191 0.185948622432} 7 O25 39 0.0 1 8 {} {0.432553312067 0.874225803191 0.483993022432} 7 O26 40 0.0 1 8 {} {0.226233302067 0.938967133191 0.192526682432} 7 O27 41 0.0 1 8 {} {0.179569815903 0.869105428984 0.519945772684} 0 O28 42 0.0 1 8 {} {0.269796012067 0.581354603191 0.358776922432} 7 O29 43 0.0 1 8 {} {0.0214423620675 0.646292393191 0.327340842432} 7 O30 44 0.0 1 8 {} {0.938252469277 0.548534779126 0.67626581241} 0 O31 45 0.0 1 14 {} {0.617619882067 0.175180013191 0.387077652432} 7 Si15 46 0.0 1 14 {} {0.862290722067 0.100892933191 0.308549092432} 7 Si16 47 0.0 1 14 {} {0.812163627364 0.122004913111 0.616472293528} 0 Si17 48 0.0 1 14 {} {0.589490382067 0.370990383191 0.148886272432} 7 Si18 49 0.0 1 14 {} {0.592843442067 0.426669803191 0.461333472432} 7 Si19 50 0.0 1 14 {} {0.839726092067 0.349538363191 0.229835102432} 7 Si20 51 0.0 1 14 {} {0.830448153413 0.353997504504 0.536224565921} 0 Si21 52 0.0 1 8 {} {0.550685572067 0.991800093191 0.104870042432} 7 O32 53 0.0 1 8 {} {0.568262892067 0.084247313191 0.441856582432} 7 O33 54 0.0 1 8 {} {0.810150942067 0.198903263191 0.256845582432} 7 O34 55 0.0 1 8 {} {0.780123435589 0.200209784387 0.55567944341} 0 O35 56 0.0 1 8 {} {0.643212542067 0.240813023191 0.108633162432} 7 O36 57 0.0 1 8 {} {0.651529742067 0.328680093191 0.410567842432} 7 O37 58 0.0 1 8 {} {0.871797762067 0.448877243191 0.283914862432} 7 O38 59 0.0 1 8 {} {0.912230383157 0.431010259636 0.586507095834} 0 O39 60 0.0 1 8 {} {0.967836872067 0.333310873191 0.186251642432} 7 O40 61 0.0 1 8 {} {0.939176292067 0.330484303191 0.487482012432} 7 O41 62 0.0 1 8 {} {0.708985832067 0.409300543191 0.194905742432} 7 O42 63 0.0 1 8 {} {0.698534243328 0.437579605244 0.514851408848} 0 O43 64 0.0 1 8 {} {0.751522762067 0.101492723191 0.360185472432} 7 O44 65 0.0 1 8 {} {0.668233431849 0.0948047831218 0.651608245673} 0 O45 66 0.0 1 8 {} {0.500978742067 0.189948003191 0.338279212432} 7 O46 67 0.0 1 8 {} {0.395173493029 0.146779198136 0.663705296435} 0 O47 68 0.0 1 14 {} {0.624998582067 0.680805843191 0.385493652432} 7 Si22 69 0.0 1 14 {} {0.868688172067 0.606609713191 0.305423152432} 7 Si23 70 0.0 1 14 {} {0.816123574058 0.657846767953 0.653386536574} 0 Si24 71 0.0 1 14 {} {0.596796972067 0.871515993191 0.147948662432} 7 Si25 72 0.0 1 14 {} {0.582863632067 0.926862013191 0.463573942432} 7 Si26 73 0.0 1 14 {} {0.849823682067 0.852289983191 0.226783492432} 7 Si27 74 0.0 1 14 {} {0.833408483671 0.856737443464 0.545267835957} 0 Si28 75 0.0 1 8 {} {0.546917982067 0.492993143191 0.106077332432} 7 O48 76 0.0 1 8 {} {0.580586802067 0.583017753191 0.438426482432} 7 O49 77 0.0 1 8 {} {0.818875652067 0.699681903191 0.251786632432} 7 O50 78 0.0 1 8 {} {0.820613613955 0.719759874751 0.587149738145} 0 O51 79 0.0 1 8 {} {0.647328432067 0.739860703191 0.107869312432} 7 O52 80 0.0 1 8 {} {0.641161462067 0.834715683191 0.411289022432} 7 O53 81 0.0 1 8 {} {0.882286142067 0.948604983191 0.281931292432} 7 O54 82 0.0 1 8 {} {0.885124373711 0.978631046774 0.593296935431} 0 O55 83 0.0 1 8 {} {0.977824622067 0.838613003191 0.183224262432} 7 O56 84 0.0 1 8 {} {0.929372282067 0.832592433191 0.486365792432} 7 O57 85 0.0 1 8 {} {0.719492732067 0.913529833191 0.191991422432} 7 O58 86 0.0 1 8 {} {0.686179581585 0.909481081086 0.519610728454} 0 O59 87 0.0 1 8 {} {0.768938472067 0.626017823191 0.360135122432} 7 O60 88 0.0 1 8 {} {0.677612649868 0.566342943111 0.665919394317} 0 O61 89 0.0 1 8 {} {0.512904072067 0.685438433191 0.334574572432} 7 O62 90 0.0 1 8 {} {0.398293963871 0.618434605507 0.674047290316} 0 O63 91 0.0 1 1 {} {0.0958746920675 0.116058063191 0.107809832432} 7 H1 92 0.0 1 1 {} {0.192447732067 0.301813543191 0.0730892424322} 7 H2 93 0.0 1 1 {} {0.0886628920675 0.616097223191 0.110104792432} 7 H3 94 0.0 1 1 {} {0.202761682067 0.792123693191 0.0714078924322} 7 H4 95 0.0 1 1 {} {0.585079422067 0.087928843191 0.108587142432} 7 H5 96 0.0 1 1 {} {0.681822882067 0.268061853191 0.0721301124322} 7 H6 97 0.0 1 1 {} {0.585349732067 0.587631143191 0.108859152432} 7 H7 98 0.0 1 1 {} {0.687311592067 0.765795913191 0.0714534224322} 7 H8 99 0.0 1 14 {} {0.964208001018 0.389231473362 0.650457504358} 0 Si29 100 0.0 1 14 {} {0.545609610695 0.215225629784 0.654119786513} 0 Si30 101 0.0 1 8 {} {0.568179612755 0.329732012042 0.702853871799} 0 O64 102 0.0 1 14 {} {0.640058311765 0.473175630921 0.722901043979} 0 Si31 103 0.0 1 8 {} {0.545982319679 0.280183384148 0.589307586991} 0 O65 104 0.0 1 1 {} {0.613558232541 0.235169746719 0.564412365421} 0 H9 105 0.0 1 1 {} {0.0811502033083 0.0199037101601 0.618108686649} 0 H10 106 0.0 1 8 {} {0.832181481434 0.783447959316 0.699519009156} 0 O66 107 0.0 1 1 {} {0.77086241327 0.861584087559 0.695723638852} 0 H11 108 0.0 1 8 {} {0.120941194841 0.364406595836 0.671407308072} 0 O67 109 0.0 1 1 {} {0.144766815738 0.266526353244 0.671861521373} 0 H12 110 0.0 1 8 {} {0.158629691667 0.65243181833 0.62036915933} 0 O68 111 0.0 1 1 {} {0.102433230514 0.618698360809 0.652147029759} 0 H13 112 0.0 1 8 {} {0.778938119568 0.418104382832 0.756758277898} 0 O69 113 0.0 1 1 {} {0.848984242461 0.48666955357 0.764490615395} 0 H14 114 0.0 1 8 {} {0.54649088929 0.56151246002 0.768268882153} 0 O70 115 0.0 1 1 {} {0.568724243695 0.541739141409 0.807822780939} 0 H15 116 0.0 1 1 {} {0.378254544986 0.695041996369 0.699001162996} 0 H16 117 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} {9.74432 9.74432 23.42768 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{9.74432 0 0} {0 9.74432 0} {0 0 23.42768}} {{0.102623887557 0 0} {0 0.102623887557 0} {0 0 0.0426845509244}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 76 68 0 0 49 16 0 0 16 6 0 0 57 45 0 0 84 74 0 0 71 52 0 0 61 4 0 0 35 27 0 0 102 88 0 0 60 50 0 0 81 46 0 0 95 52 0 0 39 29 0 0 13 5 0 0 21 0 0 0 46 21 0 0 43 23 0 0 59 51 0 0 103 100 0 0 26 7 0 0 17 5 0 0 37 29 0 0 66 45 0 0 32 28 0 0 70 44 0 0 77 73 0 0 105 20 0 0 80 72 0 0 48 15 0 0 58 50 0 0 12 0 0 0 17 3 0 0 40 26 0 0 85 71 0 0 55 47 0 0 40 28 0 0 27 8 0 0 90 25 0 0 31 23 0 0 19 0 0 0 14 6 0 0 42 23 0 0 82 74 0 0 37 2 0 0 93 30 0 0 63 51 0 0 79 71 0 0 8 0 0 0 57 49 0 0 76 49 0 0 25 14 0 0 33 25 0 0 106 70 0 0 65 47 0 0 78 70 0 0 89 24 0 0 67 2 0 0 75 48 0 0 31 4 0 0 116 90 0 0 96 56 0 0 101 100 0 0 87 69 0 0 84 27 0 0 10 2 0 0 94 34 0 0 69 58 0 0 77 69 0 0 107 106 0 0 10 6 0 0 53 45 0 0 109 108 0 0 36 28 0 0 87 68 0 0 35 23 0 0 61 51 0 0 82 47 0 0 80 68 0 0 18 6 0 0 89 68 0 0 33 29 0 0 78 74 0 0 81 73 0 0 108 99 0 0 69 43 0 0 102 101 0 0 18 4 0 0 41 27 0 0 54 50 0 0 86 72 0 0 56 48 0 0 41 29 0 0 104 103 0 0 9 1 0 0 32 24 0 0 92 11 0 0 9 5 0 0 112 102 0 0 72 53 0 0 110 25 0 0 91 7 0 0 111 110 0 0 34 26 0 0 113 112 0 0 19 1 0 0 42 24 0 0 115 114 0 0 64 46 0 0 11 3 0 0 30 3 0 0 85 73 0 0 47 22 0 0 60 3 0 0 54 46 0 0 97 75 0 0 66 1 0 0 88 70 0 0 99 59 0 0 114 102 0 0 83 26 0 0 24 13 0 0 99 44 0 0 64 45 0 0 98 79 0 0 55 51 0 0 71 38 0 0 15 5 0 0 100 67 0 0 100 65 0 0 62 48 0 0 12 4 0 0 86 74 0 0 20 2 0 0 62 50 0 0 38 28 0 0 83 73 0 0 72 39 0 0 99 22 0 0 63 49 0 0 36 1 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 68 76 {0 0 0} 0 1 16 49 {0 0 0} 0 2 6 16 {0 0 0} 0 3 45 57 {0 0 0} 0 4 74 84 {0 0 0} 0 5 52 71 {0 0 0} 0 6 4 61 {-1 0 0} 0 7 35 27 {0 0 0} 0 8 102 88 {0 0 0} 0 9 50 60 {0 0 0} 0 10 81 46 {0 1 0} 0 11 52 95 {0 1 0} 0 12 39 29 {0 0 0} 0 13 13 5 {0 0 0} 0 14 0 21 {0 0 0} 0 15 21 46 {-1 0 0} 0 16 23 43 {0 0 0} 0 17 59 51 {0 0 0} 0 18 100 103 {0 0 0} 0 19 7 26 {0 -1 0} 0 20 17 5 {0 0 0} 0 21 29 37 {0 0 0} 0 22 66 45 {0 0 0} 0 23 28 32 {0 0 0} 0 24 44 70 {0 0 0} 0 25 73 77 {0 0 0} 0 26 20 105 {0 0 0} 0 27 80 72 {0 0 0} 0 28 48 15 {0 0 0} 0 29 50 58 {0 0 0} 0 30 12 0 {0 0 0} 0 31 3 17 {0 0 0} 0 32 26 40 {0 0 0} 0 33 71 85 {0 0 0} 0 34 55 47 {0 0 0} 0 35 40 28 {0 0 0} 0 36 8 27 {0 -1 0} 0 37 90 25 {0 0 0} 0 38 31 23 {0 0 0} 0 39 0 19 {0 0 0} 0 40 6 14 {0 0 0} 0 41 23 42 {0 0 0} 0 42 74 82 {0 0 0} 0 43 37 2 {0 1 0} 0 44 30 93 {0 0 0} 0 45 51 63 {0 0 0} 0 46 79 71 {0 0 0} 0 47 0 8 {0 0 0} 0 48 49 57 {0 0 0} 0 49 49 76 {0 0 0} 0 50 25 14 {0 0 0} 0 51 25 33 {0 0 0} 0 52 106 70 {0 0 0} 0 53 47 65 {0 0 0} 0 54 70 78 {0 0 0} 0 55 89 24 {0 0 0} 0 56 2 67 {0 0 0} 0 57 75 48 {0 0 0} 0 58 31 4 {0 0 0} 0 59 90 116 {0 0 0} 0 60 96 56 {0 0 0} 0 61 100 101 {0 0 0} 0 62 87 69 {0 0 0} 0 63 84 27 {1 0 0} 0 64 2 10 {0 0 0} 0 65 34 94 {0 0 0} 0 66 69 58 {0 0 0} 0 67 69 77 {0 0 0} 0 68 106 107 {0 0 0} 0 69 10 6 {0 0 0} 0 70 45 53 {0 0 0} 0 71 108 109 {0 0 0} 0 72 36 28 {0 0 0} 0 73 87 68 {0 0 0} 0 74 35 23 {0 0 0} 0 75 51 61 {0 0 0} 0 76 82 47 {0 1 0} 0 77 80 68 {0 0 0} 0 78 18 6 {0 0 0} 0 79 68 89 {0 0 0} 0 80 29 33 {0 0 0} 0 81 74 78 {0 0 0} 0 82 81 73 {0 0 0} 0 83 99 108 {1 0 0} 0 84 43 69 {-1 0 0} 0 85 102 101 {0 0 0} 0 86 4 18 {0 0 0} 0 87 27 41 {0 0 0} 0 88 50 54 {0 0 0} 0 89 72 86 {0 0 0} 0 90 56 48 {0 0 0} 0 91 41 29 {0 0 0} 0 92 104 103 {0 0 0} 0 93 1 9 {0 0 0} 0 94 32 24 {0 0 0} 0 95 11 92 {0 0 0} 0 96 5 9 {0 0 0} 0 97 112 102 {0 0 0} 0 98 53 72 {0 -1 0} 0 99 110 25 {0 0 0} 0 100 7 91 {0 0 0} 0 101 111 110 {0 0 0} 0 102 26 34 {0 0 0} 0 103 113 112 {0 0 0} 0 104 1 19 {0 0 0} 0 105 24 42 {0 0 0} 0 106 115 114 {0 0 0} 0 107 64 46 {0 0 0} 0 108 3 11 {0 0 0} 0 109 3 30 {0 0 0} 0 110 85 73 {0 0 0} 0 111 47 22 {0 0 0} 0 112 60 3 {1 0 0} 0 113 46 54 {0 0 0} 0 114 97 75 {0 0 0} 0 115 66 1 {0 0 0} 0 116 88 70 {0 0 0} 0 117 59 99 {0 0 0} 0 118 114 102 {0 0 0} 0 119 26 83 {-1 0 0} 0 120 13 24 {0 0 0} 0 121 44 99 {0 0 0} 0 122 64 45 {0 0 0} 0 123 98 79 {0 0 0} 0 124 51 55 {0 0 0} 0 125 71 38 {0 0 0} 0 126 15 5 {0 0 0} 0 127 100 67 {0 0 0} 0 128 65 100 {0 0 0} 0 129 48 62 {0 0 0} 0 130 4 12 {0 0 0} 0 131 86 74 {0 0 0} 0 132 2 20 {0 0 0} 0 133 62 50 {0 0 0} 0 134 28 38 {0 0 0} 0 135 73 83 {0 0 0} 0 136 72 39 {0 0 0} 0 137 22 99 {0 0 0} 0 138 49 63 {0 0 0} 0 139 1 36 {0 -1 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