#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 {} {0.847970739232 0.306745157595 0.0634158521724} Si1 1 0.0 1 14 {} {0.848008070307 0.385103785537 0.44481415554} Si2 2 0.0 1 14 {} {0.0977986286834 0.306762778594 0.19334087126} Si3 3 0.0 1 14 {} {0.0978485663904 0.383045248704 0.318115165833} Si4 4 0.0 1 14 {} {0.853505705111 0.540659171375 0.43514617239} Si5 5 0.0 1 14 {} {0.102844624728 0.537067605933 0.308584625794} Si6 6 0.0 1 14 {} {0.85002932603 0.458209496661 0.0646932929976} Si7 7 0.0 1 14 {} {0.844397261234 0.228886557455 0.442001648528} Si8 8 0.0 1 14 {} {0.0989401772071 0.458186455185 0.193102298995} Si9 9 0.0 1 14 {} {0.0944216816939 0.22822333116 0.314252120788} Si10 10 0.0 1 8 {} {0.36186152852 0.59297887023 0.517933294363} O1 11 0.0 1 14 {} {0.344704074065 0.656986534302 0.521371157909} Si11 12 0.0 1 8 {} {0.111223630759 0.589570651882 0.213123692137} O2 13 0.0 1 1 {} {0.0115223669698 0.593120105709 0.152765164715} H1 14 0.0 1 8 {} {0.333683272547 0.177698922158 0.541545826044} O3 15 0.0 1 1 {} {0.932875026549 0.174501435155 0.60186486083} H2 16 0.0 1 8 {} {0.0834531627729 0.176581067815 0.216013455329} O4 17 0.0 1 1 {} {0.182433121539 0.173110458062 0.155803455598} H3 18 0.0 1 14 {} {0.847924501048 0.30736908034 0.564247786435} Si12 19 0.0 1 14 {} {0.849187346358 0.383194611038 0.939085639812} Si13 20 0.0 1 14 {} {0.09812446138 0.307504989556 0.693172426181} Si14 21 0.0 1 14 {} {0.0989615862042 0.385379986184 0.812060076283} Si15 22 0.0 1 14 {} {0.850229885921 0.536925223728 0.949050499117} Si16 23 0.0 1 14 {} {0.0989208646095 0.540708074452 0.82268323008} Si17 24 0.0 1 14 {} {0.849659460943 0.463857395601 0.563120614144} Si18 25 0.0 1 14 {} {0.844349518812 0.228135160826 0.942664085509} Si19 26 0.0 1 14 {} {0.0986420011303 0.464060087082 0.693287366801} Si20 27 0.0 1 14 {} {0.0943920701593 0.228910614679 0.814911360569} Si21 28 0.0 1 8 {} {0.360971166085 0.58861814564 0.0462577825412} O5 29 0.0 1 1 {} {0.261377575066 0.593249629081 0.106230874813} H4 30 0.0 1 8 {} {0.11139971795 0.596246805494 0.742826206546} O6 31 0.0 1 1 {} {0.0137155748933 0.621476818545 0.740973804105} H5 32 0.0 1 8 {} {0.333410552087 0.176451660724 0.0410427395078} O7 33 0.0 1 1 {} {0.932534126676 0.173168419786 0.101299281819} H6 34 0.0 1 8 {} {0.0836546175898 0.177884152038 0.71495385199} O8 35 0.0 1 1 {} {0.18298605395 0.174536536301 0.654850666353} H7 36 0.0 1 14 {} {0.347749247305 0.306645182448 0.0635060094541} Si22 37 0.0 1 14 {} {0.348301485761 0.384910424477 0.444392548178} Si23 38 0.0 1 14 {} {0.597855554519 0.306662030729 0.193163277328} Si24 39 0.0 1 14 {} {0.598423715807 0.382989735487 0.317687592148} Si25 40 0.0 1 14 {} {0.355180159108 0.538852614475 0.432834866165} Si26 41 0.0 1 14 {} {0.605638559232 0.536863142254 0.307146965218} Si27 42 0.0 1 14 {} {0.348675157604 0.457819916463 0.0658809892773} Si28 43 0.0 1 14 {} {0.344555617869 0.228841089937 0.441949570372} Si29 44 0.0 1 14 {} {0.600280567051 0.457996654511 0.191947925208} Si30 45 0.0 1 14 {} {0.594482436202 0.228153118611 0.314093245041} Si31 46 0.0 1 8 {} {0.843106463063 0.595680455398 0.517704470086} O9 47 0.0 1 1 {} {0.939500361999 0.620986870623 0.517515330175} H8 48 0.0 1 8 {} {0.613655067834 0.588976577708 0.210911342178} O10 49 0.0 1 1 {} {0.512404134948 0.592955040352 0.151859745581} H9 50 0.0 1 8 {} {0.83356943143 0.177777671731 0.541703754965} O11 51 0.0 1 1 {} {0.432915660138 0.174398970658 0.601739571026} H10 52 0.0 1 8 {} {0.583559819302 0.176463072015 0.215962889137} O12 53 0.0 1 1 {} {0.682511511837 0.173050636561 0.155716821891} H11 54 0.0 1 14 {} {0.348070636624 0.307308273027 0.564140081589} Si32 55 0.0 1 14 {} {0.348482690647 0.383057624374 0.939342961019} Si33 56 0.0 1 14 {} {0.597987640778 0.307407722287 0.693284235645} Si34 57 0.0 1 14 {} {0.598819562983 0.385134051584 0.812707481897} Si35 58 0.0 1 14 {} {0.34784666822 0.536488378273 0.950415714258} Si36 59 0.0 1 14 {} {0.59746055187 0.538626348973 0.824956771519} Si37 60 0.0 1 14 {} {0.349013011218 0.463233254911 0.563877658038} Si38 61 0.0 1 14 {} {0.344236670887 0.228083212292 0.942779413836} Si39 62 0.0 1 14 {} {0.599512436473 0.463416334928 0.692805082019} Si40 63 0.0 1 14 {} {0.594302994624 0.228883094982 0.815029732515} Si41 64 0.0 1 8 {} {0.861816222681 0.589410075079 0.0442638656282} O13 65 0.0 1 1 {} {0.761798470431 0.593327732803 0.104547101543} H12 66 0.0 1 8 {} {0.591958246964 0.593613679752 0.743147292469} O14 67 0.0 1 14 {} {0.60296721983 0.657735738127 0.741397215087} Si42 68 0.0 1 8 {} {0.833604136272 0.176532306773 0.041004238376} O15 69 0.0 1 1 {} {0.432407495887 0.173044779572 0.101263665466} H13 70 0.0 1 8 {} {0.583597889195 0.177878482683 0.715033037488} O16 71 0.0 1 1 {} {0.682945594777 0.174588633256 0.654913556827} H14 72 0.0 1 7 {} {0.467466210331 0.683636949028 0.634673233455} N 73 0.0 1 1 {} {0.457012789441 0.724652383803 0.640590560984} H16 74 0.0 1 9 {} {0.806535152736 0.672040124239 0.720876023113} F4 75 0.0 1 9 {} {0.391421371992 0.680348236984 0.388289964296} F5 76 0.0 1 9 {} {0.562111042164 0.680870373013 0.875595546611} F3 77 0.0 1 9 {} {0.139177945853 0.67017545775 0.535738322445} F1 78 0.0 1 9 {} {0.425298019066 0.793613161816 0.66481663421} F2 79 0.0 1 9 {} {0.579865031902 0.796189685484 0.562439591722} 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