#MD System 2.0 @Title neb0_image06 @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 {} {0.848922091625 0.307551308588 0.0628810554157} Si1 1 0.0 1 14 {} {0.849473316252 0.385261012729 0.444409428362} Si2 2 0.0 1 14 {} {0.0988093222626 0.307343408842 0.192506499308} Si3 3 0.0 1 14 {} {0.0990453835565 0.383393001814 0.317740899282} Si4 4 0.0 1 14 {} {0.858278025069 0.541748044957 0.43671401827} Si5 5 0.0 1 14 {} {0.10286798785 0.537454629272 0.306327127444} Si6 6 0.0 1 14 {} {0.847511634382 0.45885588799 0.0662967090646} Si7 7 0.0 1 14 {} {0.845268830066 0.22965666061 0.442015093648} Si8 8 0.0 1 14 {} {0.0992670763831 0.458462294487 0.19215811882} Si9 9 0.0 1 14 {} {0.0951173397342 0.228910429645 0.314002023292} Si10 10 0.0 1 8 {} {0.342346409546 0.592168405247 0.524893950424} O1 11 0.0 1 14 {} {0.33396160603 0.657130777366 0.522805903405} Si11 12 0.0 1 8 {} {0.112668309835 0.589688233325 0.210276199951} O2 13 0.0 1 1 {} {0.0125331933159 0.593875455443 0.149998729398} H1 14 0.0 1 8 {} {0.334255460363 0.177943965207 0.540750509566} O3 15 0.0 1 1 {} {0.933297719977 0.175068185147 0.601336996583} H2 16 0.0 1 8 {} {0.0840164454325 0.177201064919 0.215971529649} O4 17 0.0 1 1 {} {0.183022961734 0.173675837752 0.155836585497} H3 18 0.0 1 14 {} {0.849322669429 0.307982288778 0.564927636458} Si12 19 0.0 1 14 {} {0.849284445445 0.384201344964 0.93896647319} Si13 20 0.0 1 14 {} {0.0990696945991 0.308873820733 0.694100934466} Si14 21 0.0 1 14 {} {0.100104838165 0.387282674737 0.812751335685} Si15 22 0.0 1 14 {} {0.851290967635 0.53713319347 0.949182739188} Si16 23 0.0 1 14 {} {0.10056893007 0.538804508669 0.825981887863} Si17 24 0.0 1 14 {} {0.850925853079 0.464177780094 0.561306071869} Si18 25 0.0 1 14 {} {0.845293843717 0.228887910077 0.942485949039} Si19 26 0.0 1 14 {} {0.100274531717 0.4654905003 0.690962752395} Si20 27 0.0 1 14 {} {0.0954058811656 0.229962223233 0.815063749203} Si21 28 0.0 1 8 {} {0.362919978315 0.589349871207 0.0465828657723} O5 29 0.0 1 1 {} {0.262520985453 0.593772044338 0.1065719138} H4 30 0.0 1 8 {} {0.116951167024 0.602306511915 0.768081022679} O6 31 0.0 1 1 {} {0.0694301577575 0.627239888172 0.713794719417} H5 32 0.0 1 8 {} {0.334203760889 0.177360269567 0.0410848087619} O7 33 0.0 1 1 {} {0.933245721859 0.17383290735 0.101168716233} H6 34 0.0 1 8 {} {0.0844057022377 0.179272781881 0.714234749812} O8 35 0.0 1 1 {} {0.183860103755 0.175595841648 0.654365197404} H7 36 0.0 1 14 {} {0.348923290347 0.307560462897 0.062996941252} Si22 37 0.0 1 14 {} {0.349668179439 0.384719207944 0.443638150939} Si23 38 0.0 1 14 {} {0.59898204392 0.307702553907 0.192433109512} Si24 39 0.0 1 14 {} {0.59993831216 0.383818215695 0.317834066574} Si25 40 0.0 1 14 {} {0.351598338914 0.538740106733 0.432780978027} Si26 41 0.0 1 14 {} {0.606452089624 0.540423850587 0.311490948472} Si27 42 0.0 1 14 {} {0.352488775447 0.458648466743 0.0679547410968} Si28 43 0.0 1 14 {} {0.345086734917 0.229353999036 0.441867879269} Si29 44 0.0 1 14 {} {0.601103056556 0.460362570369 0.197677282927} Si30 45 0.0 1 14 {} {0.595219404756 0.229209021658 0.314090649937} Si31 46 0.0 1 8 {} {0.861076228886 0.593238645548 0.532812963997} O9 47 0.0 1 1 {} {0.949044431366 0.62136607146 0.52905230158} H8 48 0.0 1 8 {} {0.615989944652 0.590634670734 0.209612759058} O10 49 0.0 1 1 {} {0.514055802892 0.594606881641 0.150376132274} H9 50 0.0 1 8 {} {0.83407856258 0.178341142262 0.541146576031} O11 51 0.0 1 1 {} {0.433303788656 0.174612759599 0.601024601893} H10 52 0.0 1 8 {} {0.584392366743 0.177555887706 0.21587931713} O12 53 0.0 1 1 {} {0.683361466629 0.173990239466 0.155712088833} H11 54 0.0 1 14 {} {0.348598542317 0.307641603745 0.564849922244} Si32 55 0.0 1 14 {} {0.350443820758 0.384282104251 0.939458556599} Si33 56 0.0 1 14 {} {0.598905508277 0.308280922308 0.693253095589} Si34 57 0.0 1 14 {} {0.59977968764 0.386320060244 0.812220701904} Si35 58 0.0 1 14 {} {0.351479412848 0.53682867231 0.951200968335} Si36 59 0.0 1 14 {} {0.599528984394 0.540264754477 0.822617135011} Si37 60 0.0 1 14 {} {0.350715364299 0.463091116891 0.562101272213} Si38 61 0.0 1 14 {} {0.34535393879 0.228899720946 0.942636524859} Si39 62 0.0 1 14 {} {0.600860716002 0.464608984805 0.690969769832} Si40 63 0.0 1 14 {} {0.595261122696 0.229640175905 0.814941256219} Si41 64 0.0 1 8 {} {0.862327788217 0.589929112156 0.0439356722123} O13 65 0.0 1 1 {} {0.762953700066 0.593829719399 0.105097626502} H12 66 0.0 1 8 {} {0.59270356265 0.596222007107 0.742007606199} O14 67 0.0 1 14 {} {0.603375021215 0.659892917853 0.744423733353} Si42 68 0.0 1 8 {} {0.83429196289 0.17736205793 0.0409691656298} O15 69 0.0 1 1 {} {0.433247804901 0.173878754699 0.101204312776} H13 70 0.0 1 8 {} {0.584178594862 0.178802767016 0.714533517148} O16 71 0.0 1 1 {} {0.683523442622 0.175362381624 0.654476945482} H14 72 0.0 1 7 {} {0.460685112692 0.686841953752 0.635686663022} N 73 0.0 1 1 {} {0.442254602522 0.749882334092 0.648949875298} H16 74 0.0 1 9 {} {0.798195369144 0.678086818206 0.720576441129} F4 75 0.0 1 9 {} {0.317404726717 0.680135241364 0.384842756302} F5 76 0.0 1 9 {} {0.546547010612 0.680806279066 0.876680541909} F3 77 0.0 1 9 {} {0.137864965305 0.666075625624 0.570591834455} F1 78 0.0 1 9 {} {0.434349381714 0.784576653515 0.661594675004} F2 79 0.0 1 9 {} {0.566707371478 0.711091854151 0.497514374104} 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 45 38 0 0 21 19 0 0 78 73 0 0 58 42 0 0 3 1 0 0 27 20 0 0 22 6 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 0 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 0 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 45 38 {0 0 0} 0 2 19 21 {1 0 0} 0 3 73 78 {0 0 0} 0 4 42 58 {0 0 -1} 0 5 3 1 {-1 0 0} 0 6 20 27 {0 0 0} 0 7 22 6 {0 0 1} 0 8 56 54 {0 0 0} 0 9 3 37 {0 0 0} 0 10 26 60 {0 0 0} 0 11 62 24 {0 0 0} 0 12 17 16 {0 0 0} 0 13 54 43 {0 0 0} 0 14 43 45 {0 0 0} 0 15 25 27 {1 0 0} 0 16 26 21 {0 0 0} 0 17 40 10 {0 0 0} 0 18 44 6 {0 0 0} 0 19 11 77 {0 0 0} 0 20 61 36 {0 0 1} 0 21 0 38 {0 0 0} 0 22 0 2 {1 0 0} 0 23 57 19 {0 0 0} 0 24 13 12 {0 0 0} 0 25 25 0 {0 0 1} 0 26 47 46 {0 0 0} 0 27 75 11 {0 0 0} 0 28 62 60 {0 0 0} 0 29 1 24 {0 0 0} 0 30 7 18 {0 0 0} 0 31 37 54 {0 0 0} 0 32 28 29 {0 0 0} 0 33 57 56 {0 0 0} 0 34 18 56 {0 0 0} 0 35 28 58 {0 0 -1} 0 36 8 42 {0 0 0} 0 37 38 39 {0 0 0} 0 38 67 66 {0 0 0} 0 39 59 66 {0 0 0} 0 40 3 2 {0 0 0} 0 41 57 55 {0 0 0} 0 42 0 19 {0 0 -1} 0 43 27 61 {0 0 0} 0 44 63 25 {0 0 0} 0 45 48 49 {0 0 0} 0 46 54 20 {0 0 0} 0 47 68 33 {0 0 0} 0 48 39 44 {0 0 0} 0 49 62 57 {0 0 0} 0 50 25 68 {0 0 1} 0 51 6 8 {1 0 0} 0 52 53 52 {0 0 0} 0 53 45 52 {0 0 0} 0 54 45 7 {0 0 0} 0 55 72 11 {0 0 0} 0 56 50 7 {0 0 0} 0 57 72 67 {0 0 0} 0 58 34 35 {0 0 0} 0 59 41 48 {0 0 0} 0 60 10 11 {0 0 0} 0 61 8 5 {0 0 0} 0 62 1 39 {0 0 0} 0 63 61 32 {0 0 1} 0 64 14 51 {0 0 0} 0 65 50 15 {0 0 0} 0 66 20 21 {0 0 0} 0 67 63 61 {0 0 0} 0 68 55 42 {0 0 1} 0 69 38 36 {0 0 0} 0 70 30 31 {0 0 0} 0 71 26 24 {-1 0 0} 0 72 64 65 {0 0 0} 0 73 9 43 {0 0 0} 0 74 76 67 {0 0 0} 0 75 1 18 {0 0 0} 0 76 8 3 {0 0 0} 0 77 7 9 {1 0 0} 0 78 55 21 {0 0 0} 0 79 19 6 {0 0 1} 0 80 44 42 {0 0 0} 0 81 36 2 {0 0 0} 0 82 56 63 {0 0 0} 0 83 70 71 {0 0 0} 0 84 16 9 {0 0 0} 0 85 2 9 {0 0 0} 0 86 69 32 {0 0 0} 0 87 39 37 {0 0 0} 0 88 22 64 {0 0 1} 0 89 27 34 {0 0 0} 0 90 20 18 {-1 0 0} 0 91 55 36 {0 0 1} 0 92 43 14 {0 0 0} 0 93 46 4 {0 0 0} 0 94 23 30 {0 0 0} 0 95 60 37 {0 0 0} 0 96 12 5 {0 0 0} 0 97 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