#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 {} {0.849353526884 0.307871113122 0.0625564036083} Si1 1 0.0 1 14 {} {0.849971044362 0.385320906224 0.444369490805} Si2 2 0.0 1 14 {} {0.0992770943889 0.307587016898 0.192406337479} Si3 3 0.0 1 14 {} {0.0994642042266 0.383583376008 0.317579101489} Si4 4 0.0 1 14 {} {0.859965842525 0.54272647024 0.43824075568} Si5 5 0.0 1 14 {} {0.102855878053 0.537670576517 0.305494166531} Si6 6 0.0 1 14 {} {0.847114928359 0.459126429718 0.0665737231365} Si7 7 0.0 1 14 {} {0.845712507426 0.229948544226 0.442178091805} Si8 8 0.0 1 14 {} {0.0992979108179 0.458640388612 0.192036175085} Si9 9 0.0 1 14 {} {0.0954438898188 0.229168547811 0.313727997718} Si10 10 0.0 1 8 {} {0.336607292906 0.59187927647 0.524748739759} O1 11 0.0 1 14 {} {0.343265965097 0.659775124846 0.519595293945} Si11 12 0.0 1 8 {} {0.113113807586 0.589532602242 0.209152411878} O2 13 0.0 1 1 {} {0.0129767761099 0.594204086336 0.149331457731} H1 14 0.0 1 8 {} {0.334620227554 0.178036163987 0.540420210863} O3 15 0.0 1 1 {} {0.93355831516 0.175268208665 0.601081408818} H2 16 0.0 1 8 {} {0.0843465675247 0.177415925768 0.215948556741} O4 17 0.0 1 1 {} {0.183351894799 0.173892245144 0.155820501265} H3 18 0.0 1 14 {} {0.849932682316 0.308199529447 0.565066681187} Si12 19 0.0 1 14 {} {0.849316818172 0.384602033852 0.939011813716} Si13 20 0.0 1 14 {} {0.099581466783 0.309431998073 0.694553999801} Si14 21 0.0 1 14 {} {0.10055009339 0.387985590905 0.813023523373} Si15 22 0.0 1 14 {} {0.851866175949 0.537450912287 0.950336513315} Si16 23 0.0 1 14 {} {0.102991911703 0.541384643153 0.822668360531} Si17 24 0.0 1 14 {} {0.851193538807 0.464393445775 0.560377402741} Si18 25 0.0 1 14 {} {0.845702932795 0.229183479438 0.94250929532} Si19 26 0.0 1 14 {} {0.100871357062 0.466073280166 0.690351374411} Si20 27 0.0 1 14 {} {0.0958646552022 0.230356766829 0.814979085929} Si21 28 0.0 1 8 {} {0.363367805082 0.589465015751 0.0464990098512} O5 29 0.0 1 1 {} {0.263028134943 0.594034886064 0.106913241308} H4 30 0.0 1 8 {} {0.111266757013 0.60361259596 0.777636881498} O6 31 0.0 1 1 {} {0.0945433565003 0.626875169794 0.707603216195} H5 32 0.0 1 8 {} {0.334622852591 0.177693047796 0.0410567320281} O7 33 0.0 1 1 {} {0.933634654502 0.174079380203 0.101061829899} H6 34 0.0 1 8 {} {0.0847989291913 0.179778312608 0.713969283255} O8 35 0.0 1 1 {} {0.184314229142 0.175981546666 0.65417723266} H7 36 0.0 1 14 {} {0.349398895762 0.307900834709 0.0627008726226} Si22 37 0.0 1 14 {} {0.35005145613 0.384691071868 0.443420929968} Si23 38 0.0 1 14 {} {0.599433884757 0.308108763497 0.192374977383} Si24 39 0.0 1 14 {} {0.600483587438 0.384167213034 0.317851385127} Si25 40 0.0 1 14 {} {0.350159248454 0.539909756147 0.434152025441} Si26 41 0.0 1 14 {} {0.606923216596 0.541733165077 0.312719898731} Si27 42 0.0 1 14 {} {0.353767284688 0.458912279717 0.0687347376812} Si28 43 0.0 1 14 {} {0.345333444413 0.229585228618 0.442032608023} Si29 44 0.0 1 14 {} {0.601820679859 0.46127804881 0.199561784153} Si30 45 0.0 1 14 {} {0.595609788572 0.229628647951 0.313974119726} Si31 46 0.0 1 8 {} {0.868804588474 0.591774725645 0.537622187974} O9 47 0.0 1 1 {} {0.951875591555 0.62149099418 0.532841147748} H8 48 0.0 1 8 {} {0.616609348855 0.591169532688 0.209622367255} O10 49 0.0 1 1 {} {0.51489155677 0.595307433434 0.150488370572} H9 50 0.0 1 8 {} {0.834381881703 0.17852136378 0.540871566786} O11 51 0.0 1 1 {} {0.433623161809 0.174711461278 0.600714566017} H10 52 0.0 1 8 {} {0.584796714407 0.177966602426 0.215901797205} O12 53 0.0 1 1 {} {0.683774483068 0.174361905858 0.155765007112} H11 54 0.0 1 14 {} {0.348880758861 0.307799679454 0.564872466256} Si32 55 0.0 1 14 {} {0.35124303248 0.384737018456 0.939622872039} Si33 56 0.0 1 14 {} {0.599314518897 0.308620157317 0.693398707797} Si34 57 0.0 1 14 {} {0.600164874794 0.38673594918 0.812069923497} Si35 58 0.0 1 14 {} {0.353349166132 0.537091013341 0.952771730901} Si36 59 0.0 1 14 {} {0.600755944111 0.541161855055 0.820158357054} Si37 60 0.0 1 14 {} {0.351418643681 0.463158131964 0.561145661387} Si38 61 0.0 1 14 {} {0.345861965764 0.229209868312 0.942668552853} Si39 62 0.0 1 14 {} {0.601339688831 0.464907625871 0.69076780908} Si40 63 0.0 1 14 {} {0.595675952262 0.229941127186 0.814715996805} Si41 64 0.0 1 8 {} {0.862132091749 0.590079975894 0.0434454898633} O13 65 0.0 1 1 {} {0.763195316306 0.594160560921 0.105439493371} H12 66 0.0 1 8 {} {0.594752219356 0.596242686582 0.742732790559} O14 67 0.0 1 14 {} {0.597753095416 0.661244111701 0.744108139267} Si42 68 0.0 1 8 {} {0.834651986903 0.177675693624 0.0409130715717} O15 69 0.0 1 1 {} {0.433653805887 0.174202182658 0.101185196628} H13 70 0.0 1 8 {} {0.584523143438 0.179121488199 0.714368559433} O16 71 0.0 1 1 {} {0.683871088012 0.175629606929 0.654331576266} H14 72 0.0 1 7 {} {0.449429630195 0.687662418602 0.645110651828} N 73 0.0 1 1 {} {0.442886073276 0.750181777658 0.64684676235} H16 74 0.0 1 9 {} {0.794207878833 0.679913267807 0.720849680843} F4 75 0.0 1 9 {} {0.277463972188 0.681003168485 0.387163239236} F5 76 0.0 1 9 {} {0.542243870797 0.680568837873 0.878732822745} F3 77 0.0 1 9 {} {0.137602327881 0.664206586673 0.581880345814} F1 78 0.0 1 9 {} {0.43525721815 0.789590848998 0.662169266536} F2 79 0.0 1 9 {} {0.564929578717 0.676140999897 0.468375536604} 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