#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 {} {0.849401201249 0.307641459459 0.0628195917546} Si1 1 0.0 1 14 {} {0.849913534797 0.38516004597 0.444510276895} Si2 2 0.0 1 14 {} {0.0993865071295 0.307430522446 0.19282142442} Si3 3 0.0 1 14 {} {0.0996892448724 0.383451805403 0.318034120012} Si4 4 0.0 1 14 {} {0.859184550942 0.541907297732 0.438567671271} Si5 5 0.0 1 14 {} {0.10512517611 0.538301592941 0.306579888461} Si6 6 0.0 1 14 {} {0.850403555135 0.458641643301 0.0659864408795} Si7 7 0.0 1 14 {} {0.845569763617 0.229745809394 0.442240673693} Si8 8 0.0 1 14 {} {0.100404846098 0.458872759509 0.194146772194} Si9 9 0.0 1 14 {} {0.0954312810842 0.228996839789 0.313752392245} Si10 10 0.0 1 8 {} {0.36203347171 0.5950969176 0.518166534486} O1 11 0.0 1 14 {} {0.352999364035 0.661843043762 0.515845787022} Si11 12 0.0 1 8 {} {0.112194749755 0.58949815519 0.208972003356} O2 13 0.0 1 1 {} {0.011739316087 0.593784646576 0.149521429105} H1 14 0.0 1 8 {} {0.334661993952 0.178292059235 0.540628563175} O3 15 0.0 1 1 {} {0.933550054761 0.175121911778 0.601175058771} H2 16 0.0 1 8 {} {0.0843135061208 0.177286622689 0.215953273799} O4 17 0.0 1 1 {} {0.183294632843 0.173729257995 0.155795306051} H3 18 0.0 1 14 {} {0.849713198122 0.307982368982 0.564958877595} Si12 19 0.0 1 14 {} {0.849979838425 0.38420819739 0.938764779816} Si13 20 0.0 1 14 {} {0.0997559842818 0.30920840213 0.694241612575} Si14 21 0.0 1 14 {} {0.100416732723 0.387786511931 0.812393679224} Si15 22 0.0 1 14 {} {0.850886538921 0.537337441928 0.951034577985} Si16 23 0.0 1 14 {} {0.101912830522 0.54290668016 0.822843911852} Si17 24 0.0 1 14 {} {0.850889545047 0.464106240062 0.561476642963} Si18 25 0.0 1 14 {} {0.845609612878 0.229010286927 0.942648652983} Si19 26 0.0 1 14 {} {0.100582272233 0.466744117135 0.691697356892} Si20 27 0.0 1 14 {} {0.095808192514 0.230158974814 0.81485769248} Si21 28 0.0 1 8 {} {0.364196466831 0.588885385995 0.0470689031664} O5 29 0.0 1 1 {} {0.263551279618 0.594139665926 0.106256205734} H4 30 0.0 1 8 {} {0.122892129612 0.603611538517 0.778248224069} O6 31 0.0 1 1 {} {0.091057928492 0.624107747319 0.703979458083} H5 32 0.0 1 8 {} {0.334481537744 0.177484708802 0.0410815053083} O7 33 0.0 1 1 {} {0.933551237014 0.173866037986 0.101044106066} H6 34 0.0 1 8 {} {0.084628033186 0.179522105652 0.714056912304} O8 35 0.0 1 1 {} {0.184153855421 0.175746597415 0.65426235492} H7 36 0.0 1 14 {} {0.349191085101 0.307657511761 0.0627716183344} Si22 37 0.0 1 14 {} {0.349407058801 0.386099454823 0.444775475051} Si23 38 0.0 1 14 {} {0.599176697043 0.307794579928 0.192762310539} Si24 39 0.0 1 14 {} {0.59974126894 0.383785109503 0.318510470793} Si25 40 0.0 1 14 {} {0.35691768293 0.542276058808 0.434221143238} Si26 41 0.0 1 14 {} {0.609293184632 0.539615652976 0.308369702435} Si27 42 0.0 1 14 {} {0.352062974132 0.458459234391 0.0679025965362} Si28 43 0.0 1 14 {} {0.345414402409 0.229756944349 0.442073981808} Si29 44 0.0 1 14 {} {0.602822411835 0.459646187785 0.195751839813} Si30 45 0.0 1 14 {} {0.595530091247 0.229348015559 0.313867202475} Si31 46 0.0 1 8 {} {0.869313396454 0.591465548797 0.535837306034} O9 47 0.0 1 1 {} {0.944325192579 0.622835297385 0.523421994805} H8 48 0.0 1 8 {} {0.615862549575 0.590966549958 0.211142041973} O10 49 0.0 1 1 {} {0.514009600029 0.595006356683 0.152643409796} H9 50 0.0 1 8 {} {0.834384249702 0.17835190746 0.540928893499} O11 51 0.0 1 1 {} {0.433776532575 0.174728637569 0.600770380735} H10 52 0.0 1 8 {} {0.58466358754 0.177712020983 0.215838856985} O12 53 0.0 1 1 {} {0.683669807742 0.174131040847 0.155701188526} H11 54 0.0 1 14 {} {0.349077128056 0.308360090395 0.564233247594} Si32 55 0.0 1 14 {} {0.350167835169 0.384327106824 0.939528058405} Si33 56 0.0 1 14 {} {0.599097111394 0.308444439323 0.693582185676} Si34 57 0.0 1 14 {} {0.599698756614 0.386499605037 0.812432456893} Si35 58 0.0 1 14 {} {0.351632377469 0.536698383657 0.95305719608} Si36 59 0.0 1 14 {} {0.59946153145 0.54065296603 0.821447670038} Si37 60 0.0 1 14 {} {0.350477188864 0.46528724889 0.561085128155} Si38 61 0.0 1 14 {} {0.345780545605 0.22900167755 0.942775212556} Si39 62 0.0 1 14 {} {0.600265581225 0.464799556008 0.6915092394} Si40 63 0.0 1 14 {} {0.595569093546 0.229721388789 0.814621026312} Si41 64 0.0 1 8 {} {0.860977526398 0.589743954868 0.0446692375738} O13 65 0.0 1 1 {} {0.761633002358 0.594642912512 0.105314629748} H12 66 0.0 1 8 {} {0.596216583355 0.596316686363 0.745999229256} O14 67 0.0 1 14 {} {0.589314254217 0.661807969971 0.747989863653} Si42 68 0.0 1 8 {} {0.834557678026 0.177476559409 0.0409073978149} O15 69 0.0 1 1 {} {0.433497798696 0.173979748599 0.101235404664} H13 70 0.0 1 8 {} {0.584553757586 0.178869813627 0.714456055497} O16 71 0.0 1 1 {} {0.683870641419 0.175358880763 0.654398421743} H14 72 0.0 1 7 {} {0.436895260393 0.688506826032 0.652865502855} N 73 0.0 1 1 {} {0.434386556027 0.752981480858 0.659688130972} H16 74 0.0 1 9 {} {0.784330232234 0.679803902444 0.717531324006} F4 75 0.0 1 9 {} {0.275393698424 0.681052781648 0.384078776803} F5 76 0.0 1 9 {} {0.552099564772 0.678489317758 0.887805634154} F3 77 0.0 1 9 {} {0.140668668199 0.663340504723 0.574911153284} F1 78 0.0 1 9 {} {0.436221190377 0.791657306357 0.658507555056} F2 79 0.0 1 9 {} {0.55727342174 0.675361693071 0.46589854566} 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