#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 {} {0.849327677769 0.307804781117 0.0626040598846} Si1 1 0.0 1 14 {} {0.849889517097 0.385261843874 0.444468457672} Si2 2 0.0 1 14 {} {0.0992471256376 0.307524893633 0.192569219166} Si3 3 0.0 1 14 {} {0.0992485171897 0.383568052052 0.317502626297} Si4 4 0.0 1 14 {} {0.859396309032 0.542609105719 0.438507229661} Si5 5 0.0 1 14 {} {0.103113157469 0.537739109071 0.305578462838} Si6 6 0.0 1 14 {} {0.847344201609 0.459018230721 0.0664327087457} Si7 7 0.0 1 14 {} {0.845646900075 0.229859160692 0.442228347376} Si8 8 0.0 1 14 {} {0.0993219084676 0.458682417292 0.192343210776} Si9 9 0.0 1 14 {} {0.0953896693521 0.229099528475 0.313681158226} Si10 10 0.0 1 8 {} {0.353967193606 0.595844354659 0.516416344321} O1 11 0.0 1 14 {} {0.349053788192 0.662668000944 0.517218036996} Si11 12 0.0 1 8 {} {0.112829874549 0.589391013617 0.209353256122} O2 13 0.0 1 1 {} {0.0130596848894 0.594062189061 0.149808236026} H1 14 0.0 1 8 {} {0.334605363118 0.178041011303 0.540481199398} O3 15 0.0 1 1 {} {0.933518493565 0.175230590353 0.601126074124} H2 16 0.0 1 8 {} {0.0842910330162 0.177352646938 0.215940551917} O4 17 0.0 1 1 {} {0.183306176166 0.173837743384 0.155829409367} H3 18 0.0 1 14 {} {0.849824098548 0.30809837661 0.564972363141} Si12 19 0.0 1 14 {} {0.849380341077 0.384525314296 0.939153602071} Si13 20 0.0 1 14 {} {0.0995240038854 0.309287493589 0.694508390495} Si14 21 0.0 1 14 {} {0.100329993948 0.387720438398 0.812983795377} Si15 22 0.0 1 14 {} {0.85111167853 0.537247121994 0.95048545109} Si16 23 0.0 1 14 {} {0.102293778044 0.54271418381 0.822198218084} Si17 24 0.0 1 14 {} {0.850898203996 0.464361487522 0.560219046428} Si18 25 0.0 1 14 {} {0.845655593355 0.229117969455 0.942603529237} Si19 26 0.0 1 14 {} {0.100598054764 0.465792218107 0.690423462432} Si20 27 0.0 1 14 {} {0.0958036252652 0.230265062375 0.814881551959} Si21 28 0.0 1 8 {} {0.363365257845 0.589265109396 0.0464471800931} O5 29 0.0 1 1 {} {0.263278235889 0.593926062801 0.106493496976} H4 30 0.0 1 8 {} {0.113612374228 0.60369596868 0.778898716189} O6 31 0.0 1 1 {} {0.0919485345961 0.62530443114 0.707187592094} H5 32 0.0 1 8 {} {0.33453856105 0.177599250959 0.0410700510168} O7 33 0.0 1 1 {} {0.933581468184 0.174007425987 0.101062959444} H6 34 0.0 1 8 {} {0.0846932622677 0.179661261802 0.713987735671} O8 35 0.0 1 1 {} {0.184229006316 0.175885454652 0.654237677476} H7 36 0.0 1 14 {} {0.349326811922 0.307816016187 0.0627344080661} Si22 37 0.0 1 14 {} {0.349860408346 0.384833031799 0.443430345869} Si23 38 0.0 1 14 {} {0.599380350518 0.308024941616 0.192524261219} Si24 39 0.0 1 14 {} {0.60047346318 0.384006334874 0.318011359314} Si25 40 0.0 1 14 {} {0.352248839874 0.541843217438 0.435295073228} Si26 41 0.0 1 14 {} {0.607213947344 0.54065815125 0.310786891085} Si27 42 0.0 1 14 {} {0.353439474129 0.458946944231 0.0684486309121} Si28 43 0.0 1 14 {} {0.345323866244 0.229539053757 0.442058246851} Si29 44 0.0 1 14 {} {0.60200340776 0.46065212826 0.198486192667} Si30 45 0.0 1 14 {} {0.595583152311 0.229537836838 0.313913999811} Si31 46 0.0 1 8 {} {0.867166786219 0.591773551946 0.536393736094} O9 47 0.0 1 1 {} {0.949803335911 0.621470075587 0.529676673948} H8 48 0.0 1 8 {} {0.614905627182 0.591262155634 0.211542145411} O10 49 0.0 1 1 {} {0.514972398383 0.594984189001 0.151306221933} H9 50 0.0 1 8 {} {0.834371447101 0.178459497988 0.540896281467} O11 51 0.0 1 1 {} {0.433616441445 0.174698124845 0.600746697502} H10 52 0.0 1 8 {} {0.584758155711 0.177872135588 0.215917160218} O12 53 0.0 1 1 {} {0.683694811153 0.174277451445 0.15575236211} H11 54 0.0 1 14 {} {0.348886309355 0.307806934862 0.564751470356} Si32 55 0.0 1 14 {} {0.350952970538 0.384675630836 0.939820557734} Si33 56 0.0 1 14 {} {0.599258511392 0.308554010236 0.693519915402} Si34 57 0.0 1 14 {} {0.600078245738 0.386641660569 0.812154564632} Si35 58 0.0 1 14 {} {0.352823794504 0.537041081656 0.952555938354} Si36 59 0.0 1 14 {} {0.600611589788 0.540543913398 0.821411742551} Si37 60 0.0 1 14 {} {0.351372881688 0.46370511095 0.56122338806} Si38 61 0.0 1 14 {} {0.345789904964 0.229123822102 0.942745663644} Si39 62 0.0 1 14 {} {0.601384039013 0.464827469861 0.691256762602} Si40 63 0.0 1 14 {} {0.595634279721 0.229862530237 0.814644158446} Si41 64 0.0 1 8 {} {0.861654045819 0.589906640878 0.0435512260939} O13 65 0.0 1 1 {} {0.763431551593 0.59417380046 0.105022617876} H12 66 0.0 1 8 {} {0.595982654279 0.595778774338 0.743377621302} O14 67 0.0 1 14 {} {0.596907381807 0.661299454973 0.745336008476} Si42 68 0.0 1 8 {} {0.834591215293 0.17759539547 0.0409317558162} O15 69 0.0 1 1 {} {0.433556118661 0.174131500605 0.101196281394} H13 70 0.0 1 8 {} {0.584472709718 0.179025947957 0.714394277997} O16 71 0.0 1 1 {} {0.683814555279 0.175545493516 0.654379258202} H14 72 0.0 1 7 {} {0.441873110518 0.687350156142 0.651329448772} N 73 0.0 1 1 {} {0.441668810881 0.750738637958 0.649693805374} H16 74 0.0 1 9 {} {0.79414421132 0.679643155 0.720085930396} F4 75 0.0 1 9 {} {0.270962740634 0.679098081568 0.383762877941} F5 76 0.0 1 9 {} {0.544674797685 0.68036604991 0.881202421578} F3 77 0.0 1 9 {} {0.134591957747 0.665114203473 0.580993275169} F1 78 0.0 1 9 {} {0.43512567921 0.789455652613 0.661177799469} F2 79 0.0 1 9 {} {0.566433242638 0.675705044598 0.471908498255} 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