#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 {} {0.849338069407 0.307827842575 0.0625833467835} Si1 1 0.0 1 14 {} {0.849924891751 0.385280256515 0.444451410256} Si2 2 0.0 1 14 {} {0.0992592156169 0.307546586838 0.192520179592} Si3 3 0.0 1 14 {} {0.0993226523684 0.383575609665 0.317510182529} Si4 4 0.0 1 14 {} {0.859668077748 0.542708512111 0.438479060498} Si5 5 0.0 1 14 {} {0.102945498761 0.537707494247 0.305477481293} Si6 6 0.0 1 14 {} {0.847220947626 0.459063284178 0.0664877450752} Si7 7 0.0 1 14 {} {0.84566723802 0.229884799096 0.442229166754} Si8 8 0.0 1 14 {} {0.0993007830628 0.458673986047 0.192236960341} Si9 9 0.0 1 14 {} {0.0954049164021 0.229118952655 0.313680269475} Si10 10 0.0 1 8 {} {0.348456020715 0.594655370437 0.519095457712} O1 11 0.0 1 14 {} {0.347218475609 0.661901922607 0.51787243159} Si11 12 0.0 1 8 {} {0.112869740953 0.589428041254 0.209276801013} O2 13 0.0 1 1 {} {0.013120502138 0.594103694727 0.149707645056} H1 14 0.0 1 8 {} {0.334606543592 0.178040816085 0.540449628027} O3 15 0.0 1 1 {} {0.933532632765 0.175243782704 0.601111927067} H2 16 0.0 1 8 {} {0.0843054829741 0.177376002927 0.21595058117} O4 17 0.0 1 1 {} {0.183322983391 0.173856497666 0.155826655614} H3 18 0.0 1 14 {} {0.849857438066 0.308132827517 0.564999338134} Si12 19 0.0 1 14 {} {0.849348984285 0.384556504607 0.939120811787} Si13 20 0.0 1 14 {} {0.0995448893122 0.309339373922 0.694528095888} Si14 21 0.0 1 14 {} {0.100406399562 0.387804220311 0.812975040885} Si15 22 0.0 1 14 {} {0.85124339994 0.537315544931 0.950411374456} Si16 23 0.0 1 14 {} {0.102575777474 0.542749275005 0.822056915958} Si17 24 0.0 1 14 {} {0.850985999901 0.464376238394 0.5602592117} Si18 25 0.0 1 14 {} {0.845668077407 0.229136583853 0.942588207737} Si19 26 0.0 1 14 {} {0.100684929573 0.465817836326 0.690311042426} Si20 27 0.0 1 14 {} {0.0958279823266 0.23029357336 0.814897637311} Si21 28 0.0 1 8 {} {0.363265191166 0.58932886171 0.0464882416429} O5 29 0.0 1 1 {} {0.263238553049 0.593957985453 0.106604925735} H4 30 0.0 1 8 {} {0.11285402222 0.603119146012 0.779356238043} O6 31 0.0 1 1 {} {0.0926092009649 0.62592632069 0.706928322782} H5 32 0.0 1 8 {} {0.334564653315 0.177633476832 0.0410580278021} O7 33 0.0 1 1 {} {0.933601024542 0.174031963639 0.101063418136} H6 34 0.0 1 8 {} {0.0847243390627 0.179703836267 0.713990552325} O8 35 0.0 1 1 {} {0.184260229689 0.175917908943 0.654217415474} H7 36 0.0 1 14 {} {0.349348831704 0.307845012798 0.0627203779125} Si22 37 0.0 1 14 {} {0.349914715779 0.384766678398 0.443433181327} Si23 38 0.0 1 14 {} {0.599396147363 0.30805484154 0.192477940451} Si24 39 0.0 1 14 {} {0.600477335388 0.384069854363 0.317941179453} Si25 40 0.0 1 14 {} {0.351443480481 0.541165858887 0.434870339962} Si26 41 0.0 1 14 {} {0.607180802338 0.540997487433 0.311368032879} Si27 42 0.0 1 14 {} {0.353571501668 0.458942288019 0.0685507102311} Si28 43 0.0 1 14 {} {0.345326537298 0.229548765003 0.442066877868} Si29 44 0.0 1 14 {} {0.601937595526 0.460872560612 0.198884999496} Si30 45 0.0 1 14 {} {0.595591897446 0.229563037126 0.313923756875} Si31 46 0.0 1 8 {} {0.867763090872 0.591796416309 0.536723670871} O9 47 0.0 1 1 {} {0.950361384209 0.621393369929 0.530743928085} H8 48 0.0 1 8 {} {0.615341343909 0.591237154923 0.210921387955} O10 49 0.0 1 1 {} {0.515037476548 0.595083892582 0.151055522697} H9 50 0.0 1 8 {} {0.83437098456 0.178484638836 0.540876843992} O11 51 0.0 1 1 {} {0.433618507833 0.1747026787 0.600736548687} H10 52 0.0 1 8 {} {0.584768152922 0.177906312644 0.215920584746} O12 53 0.0 1 1 {} {0.683722982907 0.174305557686 0.155755136487} H11 54 0.0 1 14 {} {0.348880089803 0.307800741135 0.56478567951} Si32 55 0.0 1 14 {} {0.351064929079 0.384697295538 0.939767824116} Si33 56 0.0 1 14 {} {0.599275954966 0.308575795624 0.693482321746} Si34 57 0.0 1 14 {} {0.600103836065 0.386674220723 0.812115292405} Si35 58 0.0 1 14 {} {0.353092135006 0.537069956106 0.952604808056} Si36 59 0.0 1 14 {} {0.600696161412 0.540674302281 0.82113381684} Si37 60 0.0 1 14 {} {0.351421236211 0.463471379594 0.561221400551} Si38 61 0.0 1 14 {} {0.345812262809 0.229148141831 0.942735154508} Si39 62 0.0 1 14 {} {0.601380870199 0.46486812241 0.691100804275} Si40 63 0.0 1 14 {} {0.595647316648 0.22988511204 0.814650873063} Si41 64 0.0 1 8 {} {0.861761015339 0.589970028945 0.0435557947586} O13 65 0.0 1 1 {} {0.763459784993 0.594153207062 0.10510137991} H12 66 0.0 1 8 {} {0.59547777016 0.595913282619 0.7430327717} O14 67 0.0 1 14 {} {0.597591937995 0.66126137834 0.745022884465} Si42 68 0.0 1 8 {} {0.83460831666 0.17762463985 0.0409193622483} O15 69 0.0 1 1 {} {0.433588678658 0.174155779588 0.101191986335} H13 70 0.0 1 8 {} {0.584485782012 0.179061655849 0.714394525093} O16 71 0.0 1 1 {} {0.683834175334 0.175574417932 0.65436345609} H14 72 0.0 1 7 {} {0.444120991766 0.687459476294 0.649458719302} N 73 0.0 1 1 {} {0.442132557935 0.750644204567 0.648656945672} H16 74 0.0 1 9 {} {0.794480244317 0.679753883178 0.720299154462} F4 75 0.0 1 9 {} {0.272650708773 0.679650783316 0.384663884679} F5 76 0.0 1 9 {} {0.543650997207 0.680477060489 0.880378001625} F3 77 0.0 1 9 {} {0.135025674741 0.664855553664 0.581468277219} F1 78 0.0 1 9 {} {0.435167279677 0.789322355393 0.661498987758} F2 79 0.0 1 9 {} {0.566713449261 0.67582018915 0.470874484669} 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