#MD System 2.0 @Title neb0_image02 @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 {} {0.848351797115 0.307051775422 0.0632080802031} Si1 1 0.0 1 14 {} {0.848481826552 0.385240292018 0.444839774453} Si2 2 0.0 1 14 {} {0.0982546145216 0.306966770292 0.193216745393} Si3 3 0.0 1 14 {} {0.0982458734774 0.38322805855 0.318133600935} Si4 4 0.0 1 14 {} {0.854886903686 0.540854395255 0.435903388974} Si5 5 0.0 1 14 {} {0.102660709714 0.537130231745 0.307689570436} Si6 6 0.0 1 14 {} {0.850862529941 0.458520771179 0.0647336387602} Si7 7 0.0 1 14 {} {0.844863820364 0.229160991678 0.442100460388} Si8 8 0.0 1 14 {} {0.0991648133149 0.458272839113 0.192954138155} Si9 9 0.0 1 14 {} {0.0947808892786 0.228428917845 0.314202660009} Si10 10 0.0 1 8 {} {0.355292287404 0.592185296458 0.520158099442} O1 11 0.0 1 14 {} {0.3361977135 0.656089703476 0.525757939463} Si11 12 0.0 1 8 {} {0.111171543383 0.589685409765 0.21249474791} O2 13 0.0 1 1 {} {0.0115264791456 0.593281250735 0.152076580981} H1 14 0.0 1 8 {} {0.334030679746 0.177836436786 0.541306797217} O3 15 0.0 1 1 {} {0.933134696701 0.174701743186 0.60172908888} H2 16 0.0 1 8 {} {0.0837976344866 0.176754402799 0.216049892919} O4 17 0.0 1 1 {} {0.182735043241 0.173300642466 0.155812278939} H3 18 0.0 1 14 {} {0.848655093429 0.307606190482 0.56455753507} Si12 19 0.0 1 14 {} {0.849383730004 0.38364516761 0.938998147739} Si13 20 0.0 1 14 {} {0.0987878265274 0.308002128214 0.693518569037} Si14 21 0.0 1 14 {} {0.099194321436 0.386046941712 0.81216930303} Si15 22 0.0 1 14 {} {0.851210861968 0.537292266596 0.949286364607} Si16 23 0.0 1 14 {} {0.101048156199 0.541271272983 0.82385142703} Si17 24 0.0 1 14 {} {0.850063627206 0.463976208888 0.562915489046} Si18 25 0.0 1 14 {} {0.844859390905 0.228382347361 0.942573768725} Si19 26 0.0 1 14 {} {0.0987984085978 0.46472991525 0.693235124445} Si20 27 0.0 1 14 {} {0.0949936055712 0.229240549626 0.814919892652} Si21 28 0.0 1 8 {} {0.361957379006 0.588752529973 0.0467016790685} O5 29 0.0 1 1 {} {0.262023137616 0.593559617253 0.106319282199} H4 30 0.0 1 8 {} {0.119774402908 0.597751430141 0.749000576008} O6 31 0.0 1 1 {} {0.020264039151 0.621858381513 0.738947932911} H5 32 0.0 1 8 {} {0.333915199805 0.17673821955 0.0410416932295} O7 33 0.0 1 1 {} {0.932875254977 0.173383589836 0.101261745209} H6 34 0.0 1 8 {} {0.0840908840644 0.178283976337 0.714775446947} O8 35 0.0 1 1 {} {0.18339200871 0.174853633946 0.654672201472} H7 36 0.0 1 14 {} {0.348109038965 0.306915536588 0.0632354486932} Si22 37 0.0 1 14 {} {0.348544721699 0.385001854267 0.444369887431} Si23 38 0.0 1 14 {} {0.598220218629 0.306981293442 0.193087386279} Si24 39 0.0 1 14 {} {0.598758944047 0.383374973079 0.317811840199} Si25 40 0.0 1 14 {} {0.354351659813 0.538652819646 0.432530250104} Si26 41 0.0 1 14 {} {0.606549301779 0.53749899646 0.307804112205} Si27 42 0.0 1 14 {} {0.349640761297 0.457918219956 0.0669110045708} Si28 43 0.0 1 14 {} {0.344826939027 0.22908626657 0.442022005343} Si29 44 0.0 1 14 {} {0.601596374391 0.458503085872 0.192366713382} Si30 45 0.0 1 14 {} {0.594793801687 0.228457918399 0.314179864819} Si31 46 0.0 1 8 {} {0.848303818953 0.594596980267 0.522588428659} O9 47 0.0 1 1 {} {0.940410984038 0.62139532705 0.518157445185} H8 48 0.0 1 8 {} {0.613957814344 0.589684951122 0.211697406088} O10 49 0.0 1 1 {} {0.512789248779 0.593431862398 0.152444292589} H9 50 0.0 1 8 {} {0.833898545226 0.177956923306 0.541527126989} O11 51 0.0 1 1 {} {0.4332133275 0.174515752501 0.601509471982} H10 52 0.0 1 8 {} {0.583966675241 0.176778551308 0.216027700136} O12 53 0.0 1 1 {} {0.682883374916 0.173380394092 0.155753288888} H11 54 0.0 1 14 {} {0.348547660585 0.307550645081 0.564239876111} Si32 55 0.0 1 14 {} {0.348872909522 0.383488785727 0.939297726687} Si33 56 0.0 1 14 {} {0.598464237733 0.307680385877 0.693349676508} Si34 57 0.0 1 14 {} {0.599125520806 0.385414244641 0.812529394082} Si35 58 0.0 1 14 {} {0.349201685904 0.536393168066 0.951586440579} Si36 59 0.0 1 14 {} {0.598493268823 0.538296221135 0.825692350381} Si37 60 0.0 1 14 {} {0.3487054219 0.46317958369 0.563689553743} Si38 61 0.0 1 14 {} {0.344853842493 0.22832347235 0.942686033377} Si39 62 0.0 1 14 {} {0.599574696114 0.463497015204 0.692267088927} Si40 63 0.0 1 14 {} {0.594783517316 0.229125282905 0.814915382171} Si41 64 0.0 1 8 {} {0.861567458242 0.589815386358 0.044369221885} O13 65 0.0 1 1 {} {0.76165592889 0.593778669849 0.104650003156} H12 66 0.0 1 8 {} {0.593459828364 0.593426857414 0.744480003305} O14 67 0.0 1 14 {} {0.598973220571 0.657669503669 0.74342837621} Si42 68 0.0 1 8 {} {0.833963202506 0.176796335582 0.0409709876233} O15 69 0.0 1 1 {} {0.432836841978 0.173342607295 0.101315980912} H13 70 0.0 1 8 {} {0.583969934741 0.178138056031 0.714902543991} O16 71 0.0 1 1 {} {0.683266320131 0.174822964109 0.654754541151} H14 72 0.0 1 7 {} {0.458773881027 0.68266083642 0.638906303208} N 73 0.0 1 1 {} {0.451192192619 0.723891455443 0.642514487153} H16 74 0.0 1 9 {} {0.80010129572 0.673682725129 0.719698507302} F4 75 0.0 1 9 {} {0.377368125635 0.680581580914 0.392856494739} F5 76 0.0 1 9 {} {0.560514049143 0.679852389478 0.879109821672} F3 77 0.0 1 9 {} {0.129732098633 0.668039816979 0.541327535306} F1 78 0.0 1 9 {} {0.44369343121 0.792249879497 0.65131000933} F2 79 0.0 1 9 {} {0.57580928438 0.784540431192 0.53426569439} 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 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 20 27 {0 0 0} 0 6 22 6 {0 0 1} 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 2 {1 0 0} 0 21 0 38 {0 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 68 33 {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 78 79 {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 41 44 {0 0 0} 0 84 70 71 {0 0 0} 0 85 16 9 {0 0 0} 0 86 2 9 {0 0 0} 0 87 69 32 {0 0 0} 0 88 39 37 {0 0 0} 0 89 22 64 {0 0 1} 0 90 27 34 {0 0 0} 0 91 20 18 {-1 0 0} 0 92 55 36 {0 0 1} 0 93 43 14 {0 0 0} 0 94 46 4 {0 0 0} 0 95 23 30 {0 0 0} 0 96 60 37 {0 0 0} 0 97 12 5 {0 0 0} 0 98 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