#MD System 2.0 @Title neb0_image01 @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 {} {0.847804040051 0.306653329488 0.0634414338362} Si1 1 0.0 1 14 {} {0.848075642119 0.385023894958 0.444689061305} Si2 2 0.0 1 14 {} {0.0976235597306 0.306685931409 0.193216057229} Si3 3 0.0 1 14 {} {0.0980176261492 0.382906284876 0.318099706067} Si4 4 0.0 1 14 {} {0.853693701413 0.540579257321 0.434592782403} Si5 5 0.0 1 14 {} {0.103315786611 0.537082446376 0.308553655966} Si6 6 0.0 1 14 {} {0.849163859193 0.457888228872 0.0651780515134} Si7 7 0.0 1 14 {} {0.844125078464 0.22883390126 0.441974378764} Si8 8 0.0 1 14 {} {0.0990332223779 0.458104229038 0.193078343927} Si9 9 0.0 1 14 {} {0.0941976504968 0.228203657963 0.314276277068} Si10 10 0.0 1 8 {} {0.362313415101 0.593129645998 0.518687078835} O1 11 0.0 1 14 {} {0.348730335728 0.657485678865 0.521325151357} Si11 12 0.0 1 8 {} {0.11160439127 0.58950646864 0.212890458504} O2 13 0.0 1 1 {} {0.0117487454096 0.593085425886 0.152585747817} H1 14 0.0 1 8 {} {0.333258966064 0.177607612439 0.541611419084} O3 15 0.0 1 1 {} {0.932571932741 0.174524209739 0.602050169169} H2 16 0.0 1 8 {} {0.0831299215808 0.176548193288 0.216060762146} O4 17 0.0 1 1 {} {0.182143816478 0.173076102559 0.155876133229} H3 18 0.0 1 14 {} {0.847613781854 0.307311621839 0.564207786632} Si12 19 0.0 1 14 {} {0.849072319211 0.383018593176 0.938948848012} Si13 20 0.0 1 14 {} {0.0976971920856 0.307375063962 0.693107638243} Si14 21 0.0 1 14 {} {0.0988939488214 0.385286215619 0.812002150056} Si15 22 0.0 1 14 {} {0.849679400552 0.536569824558 0.9491229004} Si16 23 0.0 1 14 {} {0.0977489914054 0.539914445304 0.82342259941} Si17 24 0.0 1 14 {} {0.849708475517 0.463854748597 0.562921796238} Si18 25 0.0 1 14 {} {0.844108800507 0.228090310946 0.942793466741} Si19 26 0.0 1 14 {} {0.0987190647775 0.463935563049 0.692957176026} Si20 27 0.0 1 14 {} {0.0940973638554 0.228858642054 0.815044761098} Si21 28 0.0 1 8 {} {0.360609263724 0.588599314919 0.0459814566069} O5 29 0.0 1 1 {} {0.26109538843 0.593138559651 0.106172498408} H4 30 0.0 1 8 {} {0.110832402993 0.596188133736 0.742609932404} O6 31 0.0 1 1 {} {0.0174633160855 0.622231618043 0.738296427495} H5 32 0.0 1 8 {} {0.333086870434 0.176419483249 0.0411065522823} O7 33 0.0 1 1 {} {0.932221720682 0.173143367956 0.101482201791} H6 34 0.0 1 8 {} {0.0833128963316 0.177852077741 0.715005382086} O8 35 0.0 1 1 {} {0.182649871752 0.174526717177 0.654886950153} H7 36 0.0 1 14 {} {0.347549666083 0.306610121428 0.0634646096852} Si22 37 0.0 1 14 {} {0.348422203636 0.384767444622 0.444351011313} Si23 38 0.0 1 14 {} {0.597672186989 0.306541274758 0.192975454837} Si24 39 0.0 1 14 {} {0.598468913252 0.38275952678 0.317717467521} Si25 40 0.0 1 14 {} {0.3553276756 0.538779402762 0.432978444942} Si26 41 0.0 1 14 {} {0.605354860621 0.536875572761 0.307219688892} Si27 42 0.0 1 14 {} {0.348632445529 0.457801661921 0.0655745118289} Si28 43 0.0 1 14 {} {0.344322759267 0.22873813095 0.441936193676} Si29 44 0.0 1 14 {} {0.599449114378 0.457900769145 0.192518369169} Si30 45 0.0 1 14 {} {0.594251469387 0.228041798436 0.313990683375} Si31 46 0.0 1 8 {} {0.842323072832 0.595811397745 0.516966873701} O9 47 0.0 1 1 {} {0.939713445816 0.620868515201 0.518962512633} H8 48 0.0 1 8 {} {0.61388168 0.588668362739 0.210038002126} O10 49 0.0 1 1 {} {0.512413892849 0.592797266208 0.15111067473} H9 50 0.0 1 8 {} {0.833274295185 0.17777271091 0.541839102085} O11 51 0.0 1 1 {} {0.432447238594 0.17435295359 0.601878475073} H10 52 0.0 1 8 {} {0.583330563388 0.176350766278 0.215871032655} O12 53 0.0 1 1 {} {0.682232720972 0.172958210204 0.15554582791} H11 54 0.0 1 14 {} {0.347779536544 0.307179111004 0.564265919464} Si32 55 0.0 1 14 {} {0.3484190729 0.382985570264 0.939125831067} Si33 56 0.0 1 14 {} {0.59773923354 0.307373725946 0.693246118858} Si34 57 0.0 1 14 {} {0.598770824797 0.385168298546 0.812614950667} Si35 58 0.0 1 14 {} {0.347414388203 0.536469629686 0.949960944857} Si36 59 0.0 1 14 {} {0.597070729168 0.538915085562 0.824502586656} Si37 60 0.0 1 14 {} {0.349200172871 0.463193879584 0.563710169011} Si38 61 0.0 1 14 {} {0.343956015375 0.228053843619 0.942855193167} Si39 62 0.0 1 14 {} {0.5995915874 0.463549319817 0.692573731181} Si40 63 0.0 1 14 {} {0.594047087898 0.228857017736 0.815161341602} Si41 64 0.0 1 8 {} {0.862094266036 0.589083292254 0.0443166369347} O13 65 0.0 1 1 {} {0.76204478256 0.593045806077 0.104713397848} H12 66 0.0 1 8 {} {0.591298769301 0.594163341321 0.7426026038} O14 67 0.0 1 14 {} {0.603624500123 0.658361990991 0.74053241925} Si42 68 0.0 1 8 {} {0.83335277111 0.176468512143 0.0410999994405} O15 69 0.0 1 1 {} {0.432140148427 0.172988604229 0.101281431491} H13 70 0.0 1 8 {} {0.583228023815 0.177885896724 0.715047289152} O16 71 0.0 1 1 {} {0.682570853082 0.17461719126 0.654895728246} H14 72 0.0 1 7 {} {0.471169693477 0.685438452836 0.633368010781} N 73 0.0 1 1 {} {0.458454985411 0.725891115705 0.640364592175} H16 74 0.0 1 9 {} {0.807957200774 0.672124705707 0.721124708624} F4 75 0.0 1 9 {} {0.390773211503 0.680293538926 0.386185028038} F5 76 0.0 1 9 {} {0.561888180791 0.681022617379 0.87484841553} F3 77 0.0 1 9 {} {0.143925457881 0.67048250373 0.537741549065} F1 78 0.0 1 9 {} {0.42065551644 0.793168337205 0.668414775289} F2 79 0.0 1 9 {} {0.578644697434 0.796018234062 0.566501825622} 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 58 42 0 0 3 1 0 0 73 72 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 2 0 0 0 38 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 79 78 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 44 41 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 42 58 {0 0 -1} 0 4 3 1 {-1 0 0} 0 5 72 73 {0 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 2 {1 0 0} 0 22 0 38 {0 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 78 79 {0 0 0} 0 68 63 61 {0 0 0} 0 69 55 42 {0 0 1} 0 70 38 36 {0 0 0} 0 71 30 31 {0 0 0} 0 72 26 24 {-1 0 0} 0 73 64 65 {0 0 0} 0 74 9 43 {0 0 0} 0 75 76 67 {0 0 0} 0 76 1 18 {0 0 0} 0 77 8 3 {0 0 0} 0 78 7 9 {1 0 0} 0 79 55 21 {0 0 0} 0 80 19 6 {0 0 1} 0 81 44 42 {0 0 0} 0 82 36 2 {0 0 0} 0 83 56 63 {0 0 0} 0 84 41 44 {0 0 0} 0 85 70 71 {0 0 0} 0 86 16 9 {0 0 0} 0 87 2 9 {0 0 0} 0 88 69 32 {0 0 0} 0 89 39 37 {0 0 0} 0 90 22 64 {0 0 1} 0 91 27 34 {0 0 0} 0 92 20 18 {-1 0 0} 0 93 55 36 {0 0 1} 0 94 43 14 {0 0 0} 0 95 46 4 {0 0 0} 0 96 23 30 {0 0 0} 0 97 60 37 {0 0 0} 0 98 12 5 {0 0 0} 0 99 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