#MD System 2.0 @Title neb0_image06 @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 {} {0.848949934614 0.30755497571 0.0629159250273} Si1 1 0.0 1 14 {} {0.849448702785 0.385214870291 0.44436903575} Si2 2 0.0 1 14 {} {0.098866893977 0.307298368984 0.192519216875} Si3 3 0.0 1 14 {} {0.0988499017531 0.383428856741 0.317683619908} Si4 4 0.0 1 14 {} {0.857277933303 0.541481583846 0.436869125937} Si5 5 0.0 1 14 {} {0.103003863153 0.53749858638 0.306836210314} Si6 6 0.0 1 14 {} {0.84774176979 0.458854420593 0.0662912750622} Si7 7 0.0 1 14 {} {0.845314139687 0.22966059613 0.442056677186} Si8 8 0.0 1 14 {} {0.0993657183254 0.458524581338 0.191775227068} Si9 9 0.0 1 14 {} {0.0951314357851 0.228906983019 0.313949056687} Si10 10 0.0 1 8 {} {0.35483610964 0.594903085536 0.517902212387} O1 11 0.0 1 14 {} {0.322751289386 0.656744363797 0.522584275888} Si11 12 0.0 1 8 {} {0.11196355432 0.589870404671 0.210780922027} O2 13 0.0 1 1 {} {0.0125818126358 0.593588150843 0.150093584715} H1 14 0.0 1 8 {} {0.334350435509 0.177964075853 0.540712917617} O3 15 0.0 1 1 {} {0.933324416509 0.175121450812 0.601314242345} H2 16 0.0 1 8 {} {0.0840329091539 0.177153839167 0.216002397872} O4 17 0.0 1 1 {} {0.183036385461 0.173718427705 0.155843943856} H3 18 0.0 1 14 {} {0.84936907216 0.307929597318 0.564944010114} Si12 19 0.0 1 14 {} {0.849323375118 0.384252659699 0.939118404894} Si13 20 0.0 1 14 {} {0.0990973491693 0.308768208163 0.69404598452} Si14 21 0.0 1 14 {} {0.0999415665917 0.387053532586 0.81300133832} Si15 22 0.0 1 14 {} {0.849959108451 0.537221532165 0.948856641477} Si16 23 0.0 1 14 {} {0.100228976115 0.542361723856 0.824197640506} Si17 24 0.0 1 14 {} {0.850819466265 0.46408829944 0.561599346456} Si18 25 0.0 1 14 {} {0.845362229184 0.228896207255 0.94252167349} Si19 26 0.0 1 14 {} {0.0998021472507 0.465555313163 0.691324223265} Si20 27 0.0 1 14 {} {0.0954647938867 0.229941513002 0.814978439761} Si21 28 0.0 1 8 {} {0.363823297786 0.58913740068 0.0464150589453} O5 29 0.0 1 1 {} {0.263147922374 0.593598014554 0.105628004915} H4 30 0.0 1 8 {} {0.130915057365 0.601843008444 0.771664020749} O6 31 0.0 1 1 {} {0.0609819960635 0.623987688894 0.715522601913} H5 32 0.0 1 8 {} {0.334188486798 0.177287575782 0.0410351997988} O7 33 0.0 1 1 {} {0.933258356704 0.173856083741 0.101127888625} H6 34 0.0 1 8 {} {0.0843896305661 0.17919663994 0.714249427024} O8 35 0.0 1 1 {} {0.183858190008 0.175618654119 0.654376473915} H7 36 0.0 1 14 {} {0.349014139928 0.307539604229 0.0630318530352} Si22 37 0.0 1 14 {} {0.349552094526 0.384918364638 0.443582170522} Si23 38 0.0 1 14 {} {0.599039862497 0.307701093531 0.192541022266} Si24 39 0.0 1 14 {} {0.600043194668 0.383663638994 0.318194031204} Si25 40 0.0 1 14 {} {0.35364639542 0.539895972202 0.43273347265} Si26 41 0.0 1 14 {} {0.606805470082 0.539637300022 0.310418802725} Si27 42 0.0 1 14 {} {0.352319937712 0.458844366897 0.0678677283183} Si28 43 0.0 1 14 {} {0.345150672778 0.229400687938 0.441894816753} Si29 44 0.0 1 14 {} {0.601283280947 0.459822845771 0.196219840113} Si30 45 0.0 1 14 {} {0.595284617309 0.229244998893 0.314001927615} Si31 46 0.0 1 8 {} {0.858636964562 0.593063679303 0.532440996644} O9 47 0.0 1 1 {} {0.946323040632 0.621067593367 0.525139978831} H8 48 0.0 1 8 {} {0.613968016926 0.591013802999 0.211923384061} O10 49 0.0 1 1 {} {0.514116372762 0.594152139245 0.151158289997} H9 50 0.0 1 8 {} {0.834138944141 0.178303589736 0.541086931693} O11 51 0.0 1 1 {} {0.433401839942 0.174678387022 0.600984897744} H10 52 0.0 1 8 {} {0.584423656818 0.177531618018 0.215932502569} O12 53 0.0 1 1 {} {0.683364935741 0.174036792618 0.155733183591} H11 54 0.0 1 14 {} {0.348693675229 0.307682343252 0.564797875756} Si32 55 0.0 1 14 {} {0.350284203894 0.384356084618 0.939725867725} Si33 56 0.0 1 14 {} {0.598965265761 0.308274895653 0.693338232343} Si34 57 0.0 1 14 {} {0.599704655665 0.386354202275 0.812235155173} Si35 58 0.0 1 14 {} {0.349573928367 0.536799518186 0.950850923774} Si36 59 0.0 1 14 {} {0.598258323694 0.539496889996 0.824670458426} Si37 60 0.0 1 14 {} {0.35050453087 0.463608740843 0.562797103653} Si38 61 0.0 1 14 {} {0.345388054649 0.228891755619 0.942691173684} Si39 62 0.0 1 14 {} {0.601079261281 0.464686881445 0.691494240263} Si40 63 0.0 1 14 {} {0.595306297692 0.229613093392 0.814864529647} Si41 64 0.0 1 8 {} {0.862059203667 0.589801053486 0.0438985758712} O13 65 0.0 1 1 {} {0.763276982021 0.593837447687 0.104435145308} H12 66 0.0 1 8 {} {0.593600873939 0.596033060669 0.743353031417} O14 67 0.0 1 14 {} {0.604431462938 0.659443761877 0.742213875018} Si42 68 0.0 1 8 {} {0.834304563535 0.177311641567 0.0409120988845} O15 69 0.0 1 1 {} {0.433212972725 0.17391616948 0.101203017077} H13 70 0.0 1 8 {} {0.584224848592 0.178716269386 0.714564266241} O16 71 0.0 1 1 {} {0.683560928004 0.175373292264 0.654483125195} H14 72 0.0 1 7 {} {0.466330614097 0.685732519993 0.626764714734} N 73 0.0 1 1 {} {0.436768251963 0.750597973366 0.652263924726} H16 74 0.0 1 9 {} {0.798010957801 0.678793763962 0.719843605535} F4 75 0.0 1 9 {} {0.314397265661 0.67706595547 0.383632543597} F5 76 0.0 1 9 {} {0.546446304367 0.680966210206 0.87316358161} F3 77 0.0 1 9 {} {0.12758374058 0.668206777093 0.571988952371} F1 78 0.0 1 9 {} {0.432720061989 0.788650923722 0.664286891869} F2 79 0.0 1 9 {} {0.582083785838 0.707625339914 0.509786353329} 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 78 73 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 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 0 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 45 38 {0 0 0} 0 2 19 21 {1 0 0} 0 3 73 78 {0 0 0} 0 4 42 58 {0 0 -1} 0 5 3 1 {-1 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 38 {0 0 0} 0 22 0 2 {1 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 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 70 71 {0 0 0} 0 84 16 9 {0 0 0} 0 85 2 9 {0 0 0} 0 86 69 32 {0 0 0} 0 87 39 37 {0 0 0} 0 88 22 64 {0 0 1} 0 89 27 34 {0 0 0} 0 90 20 18 {-1 0 0} 0 91 55 36 {0 0 1} 0 92 43 14 {0 0 0} 0 93 46 4 {0 0 0} 0 94 23 30 {0 0 0} 0 95 60 37 {0 0 0} 0 96 12 5 {0 0 0} 0 97 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