#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 {} {0.849705932918 0.307906665472 0.0626789190146} Si1 1 0.0 1 14 {} {0.850133458055 0.385258907699 0.444533215582} Si2 2 0.0 1 14 {} {0.0996469698177 0.307619289667 0.192795794397} Si3 3 0.0 1 14 {} {0.0999402468079 0.383582473459 0.318267557157} Si4 4 0.0 1 14 {} {0.861332175402 0.542378797741 0.439357010113} Si5 5 0.0 1 14 {} {0.105326705977 0.537986593306 0.30478140314} Si6 6 0.0 1 14 {} {0.849426846865 0.458874222976 0.0656898240758} Si7 7 0.0 1 14 {} {0.845875315728 0.22987126307 0.442284415443} Si8 8 0.0 1 14 {} {0.100105588553 0.458638140109 0.192907647937} Si9 9 0.0 1 14 {} {0.0957116703057 0.229130298694 0.313731132378} Si10 10 0.0 1 8 {} {0.341354864848 0.592330276174 0.523964934233} O1 11 0.0 1 14 {} {0.353560545085 0.659525993998 0.517619091652} Si11 12 0.0 1 8 {} {0.112660120424 0.589635650629 0.208358486456} O2 13 0.0 1 1 {} {0.0120539220989 0.59419075188 0.148938309869} H1 14 0.0 1 8 {} {0.334857009301 0.178378097848 0.54054206009} O3 15 0.0 1 1 {} {0.933809660798 0.17520820119 0.60105198418} H2 16 0.0 1 8 {} {0.084648238989 0.177416159686 0.215961964656} O4 17 0.0 1 1 {} {0.183633583206 0.173832218096 0.155828817932} H3 18 0.0 1 14 {} {0.850095237293 0.308124759355 0.565185502149} Si12 19 0.0 1 14 {} {0.850182163598 0.384449637514 0.938300873005} Si13 20 0.0 1 14 {} {0.100077366518 0.309542700832 0.694409648191} Si14 21 0.0 1 14 {} {0.100800014612 0.388254704246 0.812276174636} Si15 22 0.0 1 14 {} {0.852043189999 0.537812923761 0.951156553532} Si16 23 0.0 1 14 {} {0.103513346099 0.543622784705 0.820865868191} Si17 24 0.0 1 14 {} {0.8512379 0.464283053731 0.56078305388} Si18 25 0.0 1 14 {} {0.846061220607 0.229207281816 0.942594278668} Si19 26 0.0 1 14 {} {0.101298115171 0.466948075232 0.690758294062} Si20 27 0.0 1 14 {} {0.0963072469923 0.23044801063 0.814892697085} Si21 28 0.0 1 8 {} {0.363934216726 0.589218195988 0.0472155338043} O5 29 0.0 1 1 {} {0.263262286569 0.594242357604 0.106796682083} H4 30 0.0 1 8 {} {0.111343079235 0.604459950313 0.778757339508} O6 31 0.0 1 1 {} {0.11411111938 0.625490353916 0.700340336402} H5 32 0.0 1 8 {} {0.334851413625 0.177679297748 0.0411026445521} O7 33 0.0 1 1 {} {0.933894980374 0.173989430324 0.100952348454} H6 34 0.0 1 8 {} {0.0849681977678 0.179881252437 0.713962264998} O8 35 0.0 1 1 {} {0.184531682428 0.176005136883 0.65423854508} H7 36 0.0 1 14 {} {0.349540708013 0.307839835547 0.0627422174513} Si22 37 0.0 1 14 {} {0.350107351929 0.385393029999 0.444163372691} Si23 38 0.0 1 14 {} {0.599560951281 0.3080716319 0.192700861683} Si24 39 0.0 1 14 {} {0.600346948968 0.38403767233 0.318453624496} Si25 40 0.0 1 14 {} {0.354227017282 0.541354380738 0.4353821162} Si26 41 0.0 1 14 {} {0.609153239586 0.541187464154 0.310211561494} Si27 42 0.0 1 14 {} {0.353433216164 0.458614672314 0.0684869216174} Si28 43 0.0 1 14 {} {0.345604756899 0.229852776486 0.442085499751} Si29 44 0.0 1 14 {} {0.603366821439 0.460493950742 0.197540682431} Si30 45 0.0 1 14 {} {0.59580358191 0.229551862705 0.313866845024} Si31 46 0.0 1 8 {} {0.875268284231 0.590606384848 0.538894701304} O9 47 0.0 1 1 {} {0.947131484869 0.622731152402 0.528938030289} H8 48 0.0 1 8 {} {0.617397979708 0.59112225044 0.209444090459} O10 49 0.0 1 1 {} {0.514763555826 0.595648375564 0.151959621519} H9 50 0.0 1 8 {} {0.834684757873 0.178412218654 0.540785661668} O11 51 0.0 1 1 {} {0.434054606563 0.174814693282 0.600570821398} H10 52 0.0 1 8 {} {0.585018289634 0.177896474875 0.215876924332} O12 53 0.0 1 1 {} {0.683990252881 0.174298874144 0.15571991493} H11 54 0.0 1 14 {} {0.349227282273 0.308173668531 0.564539261341} Si32 55 0.0 1 14 {} {0.350624465275 0.38459339357 0.939411340334} Si33 56 0.0 1 14 {} {0.599297851012 0.308725446047 0.693543332195} Si34 57 0.0 1 14 {} {0.600011428413 0.386855384003 0.81224832437} Si35 58 0.0 1 14 {} {0.353438215128 0.536962665382 0.953841107678} Si36 59 0.0 1 14 {} {0.600041454501 0.541721731142 0.819313674432} Si37 60 0.0 1 14 {} {0.351378840673 0.464327795338 0.560695346975} Si38 61 0.0 1 14 {} {0.346246085744 0.229166051664 0.942750074896} Si39 62 0.0 1 14 {} {0.601021969564 0.465130484823 0.69108397001} Si40 63 0.0 1 14 {} {0.595996693063 0.229935999833 0.814607669145} Si41 64 0.0 1 8 {} {0.861157790401 0.590099591796 0.0446596044117} O13 65 0.0 1 1 {} {0.761746627754 0.594743089503 0.105920189498} H12 66 0.0 1 8 {} {0.592354187933 0.597265923231 0.744968804584} O14 67 0.0 1 14 {} {0.58699451071 0.663044640578 0.74592626963} Si42 68 0.0 1 8 {} {0.834898360092 0.177678481393 0.0408575549936} O15 69 0.0 1 1 {} {0.433882896888 0.174136860621 0.101222418462} H13 70 0.0 1 8 {} {0.584901771101 0.179097367802 0.714408949579} O16 71 0.0 1 1 {} {0.684220156214 0.175487321224 0.654394358643} H14 72 0.0 1 7 {} {0.439654467753 0.688731596748 0.648071429996} N 73 0.0 1 1 {} {0.433178645189 0.754066126472 0.655925760495} H16 74 0.0 1 9 {} {0.781814612839 0.681599309041 0.718029025323} F4 75 0.0 1 9 {} {0.265469590236 0.683775748178 0.394278505852} F5 76 0.0 1 9 {} {0.547756154442 0.678630068441 0.886177270701} F3 77 0.0 1 9 {} {0.139972197465 0.66072484279 0.584506312629} F1 78 0.0 1 9 {} {0.437009571032 0.79292232532 0.659433076419} F2 79 0.0 1 9 {} {0.55399740325 0.659486770607 0.451733084712} 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