#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 {} {0.847877390648 0.306674315847 0.0634426095428} Si1 1 0.0 1 14 {} {0.848065975592 0.385060826167 0.444795324225} Si2 2 0.0 1 14 {} {0.0977249319548 0.306705395592 0.193209756982} Si3 3 0.0 1 14 {} {0.0979763584597 0.382973977063 0.318079535135} Si4 4 0.0 1 14 {} {0.853458150721 0.540658554459 0.434929989787} Si5 5 0.0 1 14 {} {0.103148274644 0.537172857802 0.308807135224} Si6 6 0.0 1 14 {} {0.849582611039 0.458139973874 0.0647508521672} Si7 7 0.0 1 14 {} {0.844296870411 0.228862620295 0.441977913846} Si8 8 0.0 1 14 {} {0.0990980620094 0.458239181667 0.193151489161} Si9 9 0.0 1 14 {} {0.0943335901854 0.228210443108 0.314223381437} Si10 10 0.0 1 8 {} {0.362894538424 0.593089291158 0.518103499668} O1 11 0.0 1 14 {} {0.3456805123 0.657105334472 0.521080530973} Si11 12 0.0 1 8 {} {0.111417715394 0.589567580872 0.213019587885} O2 13 0.0 1 1 {} {0.0116456109131 0.593036012756 0.152708383055} H1 14 0.0 1 8 {} {0.333505104404 0.177649733851 0.54156674661} O3 15 0.0 1 1 {} {0.932728873268 0.174517334663 0.601926475605} H2 16 0.0 1 8 {} {0.0833010926821 0.176554347569 0.216017753371} O4 17 0.0 1 1 {} {0.182298325525 0.173102837394 0.155831078874} H3 18 0.0 1 14 {} {0.847781383446 0.307325374262 0.564255702618} Si12 19 0.0 1 14 {} {0.849080404256 0.38307718885 0.939017293097} Si13 20 0.0 1 14 {} {0.0979292336719 0.307425146823 0.693090105191} Si14 21 0.0 1 14 {} {0.0989584526739 0.385346610805 0.812074455261} Si15 22 0.0 1 14 {} {0.849886969658 0.536901503415 0.948708244689} Si16 23 0.0 1 14 {} {0.0987061958629 0.540663261376 0.822476917537} Si17 24 0.0 1 14 {} {0.849746017684 0.46389754921 0.563181852268} Si18 25 0.0 1 14 {} {0.84424988934 0.228115715712 0.942721588524} Si19 26 0.0 1 14 {} {0.0986751091588 0.464127212155 0.693227048803} Si20 27 0.0 1 14 {} {0.0942742505448 0.228873467747 0.814971769021} Si21 28 0.0 1 8 {} {0.360958638916 0.588603050348 0.0461188017444} O5 29 0.0 1 1 {} {0.261354837996 0.593170120468 0.106111616546} H4 30 0.0 1 8 {} {0.112394705664 0.596266630072 0.742385710102} O6 31 0.0 1 1 {} {0.0150441125117 0.621462611037 0.740531452727} H5 32 0.0 1 8 {} {0.33325202307 0.176436692755 0.041078412618} O7 33 0.0 1 1 {} {0.932400249906 0.173167639964 0.101349312759} H6 34 0.0 1 8 {} {0.0834924673421 0.177861065326 0.714959087042} O8 35 0.0 1 1 {} {0.182835305604 0.174536460776 0.65486243108} H7 36 0.0 1 14 {} {0.347685532585 0.306623626653 0.0634940931303} Si22 37 0.0 1 14 {} {0.3482904088 0.384964916452 0.44453391047} Si23 38 0.0 1 14 {} {0.597758528392 0.306576292318 0.19301549983} Si24 39 0.0 1 14 {} {0.598395485796 0.382833670245 0.317753475178} Si25 40 0.0 1 14 {} {0.355480335269 0.538862007514 0.432825523425} Si26 41 0.0 1 14 {} {0.605462313109 0.536888544515 0.30718630027} Si27 42 0.0 1 14 {} {0.348654325945 0.457876554298 0.0656412791609} Si28 43 0.0 1 14 {} {0.344457053798 0.228793967013 0.441942164009} Si29 44 0.0 1 14 {} {0.599832126851 0.457982032008 0.192278674294} Si30 45 0.0 1 14 {} {0.594386242052 0.228110761007 0.314045027819} Si31 46 0.0 1 8 {} {0.842897981563 0.595718091034 0.517545699635} O9 47 0.0 1 1 {} {0.939760188704 0.620887038498 0.518029685459} H8 48 0.0 1 8 {} {0.613592449315 0.588883320655 0.210672311093} O10 49 0.0 1 1 {} {0.512400727087 0.592853182152 0.151588296673} H9 50 0.0 1 8 {} {0.833430039826 0.177775377256 0.541755017881} O11 51 0.0 1 1 {} {0.432726472576 0.174379414452 0.601777882854} H10 52 0.0 1 8 {} {0.583448333559 0.176421521174 0.215933073922} O12 53 0.0 1 1 {} {0.682387380118 0.173027064386 0.155681415358} H11 54 0.0 1 14 {} {0.348003914013 0.307270897646 0.564203367951} Si32 55 0.0 1 14 {} {0.348482902151 0.38303139589 0.939263057232} Si33 56 0.0 1 14 {} {0.597888011127 0.307418898382 0.693304070296} Si34 57 0.0 1 14 {} {0.598742159143 0.385211781092 0.812619857379} Si35 58 0.0 1 14 {} {0.347300225153 0.536513753919 0.950173781815} Si36 59 0.0 1 14 {} {0.596859786504 0.538738909155 0.824844135316} Si37 60 0.0 1 14 {} {0.349025539283 0.46342306758 0.563923674236} Si38 61 0.0 1 14 {} {0.344118433295 0.228066019907 0.94281209151} Si39 62 0.0 1 14 {} {0.599515554358 0.463566603944 0.692630135551} Si40 63 0.0 1 14 {} {0.59419102938 0.228869149327 0.815089649114} Si41 64 0.0 1 8 {} {0.861836575459 0.589250238233 0.0443426274715} O13 65 0.0 1 1 {} {0.761881952213 0.593247095856 0.104724429666} H12 66 0.0 1 8 {} {0.591892093462 0.593793640594 0.742863041137} O14 67 0.0 1 14 {} {0.603877077359 0.657872197577 0.741123925074} Si42 68 0.0 1 8 {} {0.833481241584 0.176508933635 0.0410459371373} O15 69 0.0 1 1 {} {0.432271351392 0.173030023002 0.101267127357} H13 70 0.0 1 8 {} {0.583428673302 0.177880130566 0.715032065271} O16 71 0.0 1 1 {} {0.682781668949 0.174605701466 0.654918902098} H14 72 0.0 1 7 {} {0.468345234165 0.683910949648 0.634296821441} N 73 0.0 1 1 {} {0.457911627033 0.72494762618 0.640213635808} H16 74 0.0 1 9 {} {0.807244228504 0.672196013604 0.72149150739} F4 75 0.0 1 9 {} {0.390681377646 0.68026813575 0.387986776915} F5 76 0.0 1 9 {} {0.562244718436 0.681104757476 0.874807997036} F3 77 0.0 1 9 {} {0.140522606639 0.670551147358 0.536557051358} F1 78 0.0 1 9 {} {0.423525023494 0.793499134703 0.666189582227} F2 79 0.0 1 9 {} {0.57888953208 0.79562281153 0.564082894936} 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