#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 WyckoffPosition int -1 @end @data 7 {} {0.286071861277 0.462065042701 0.520316504092} N1 1 1 14 {} {0.354685277712 0.576898363082 0.540919186147} Si1 2 1 14 {} {0.170882388838 0.472688732857 0.496176460292} Si2 3 1 14 {} {0.331150460476 0.326929228969 0.525322160606} Si3 4 1 8 {} {0.427720643402 0.596751124556 0.437736292404} O 5 1 1 {} {0.296308680374 0.676511228213 0.553929229481} H1 6 1 1 {} {0.41402830699 0.557826649557 0.638253450721} H2 7 1 1 {} {0.146711084009 0.593172196454 0.493462205671} H3 8 1 1 {} {0.11979828445 0.415405380184 0.586271375735} H4 9 1 1 {} {0.146609455688 0.419970823116 0.387517807401} H5 10 1 1 {} {0.393339813196 0.306311342094 0.430251996412} H6 11 1 1 {} {0.255198749872 0.24684654716 0.517408795594} H7 12 1 1 {} {0.380723383938 0.309163327911 0.63164033712} H8 13 1 1 {} {0.404698463628 0.618207413981 0.365183894036} H10 14 1 7 {} {0.748026886539 0.490603961376 0.550252673398} N3 15 1 14 {} {0.708492793849 0.473133939847 0.413968142955} Si4 16 1 14 {} {0.851153651022 0.551853071946 0.577424945605} Si5 17 1 14 {} {0.683508395359 0.440039077955 0.660693799427} Si6 18 1 7 {} {0.596080323294 0.448050962623 0.417185744358} N4 19 1 1 {} {0.733408675625 0.57603757815 0.350897918588} H11 20 1 1 {} {0.749672017243 0.373643439082 0.359428401738} H12 21 1 1 {} {0.895889594748 0.574553163269 0.468379563031} H13 22 1 1 {} {0.909561153623 0.476304923119 0.644403295064} H14 23 1 1 {} {0.84238224932 0.659263722217 0.639692529044} H15 24 1 1 {} {0.600174744026 0.505572763501 0.679084541656} H16 25 1 1 {} {0.740062138221 0.450910613305 0.763028347679} H17 26 1 1 {} {0.659230922293 0.320261255589 0.645788154204} H18 27 1 1 {} {0.570863912089 0.376520628665 0.384898131193} H19 28 1 1 {} {0.547999639198 0.50747185186 0.426904690475} H20 29 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} {15 12 12 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{15 0 0} {0 12 0} {0 0 12}} {{0.0666666666667 0 0} {0 0.0833333333333 0} {0 0 0.0833333333333}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 27 18 0 0 2 0 0 0 15 14 0 0 10 3 0 0 6 1 0 0 26 17 0 0 7 2 0 0 8 2 0 0 21 16 0 0 28 18 0 0 9 2 0 0 20 15 0 0 19 15 0 0 1 0 0 0 4 1 0 0 5 1 0 0 25 17 0 0 18 15 0 0 13 4 0 0 3 0 0 0 16 14 0 0 17 14 0 0 12 3 0 0 24 17 0 0 23 16 0 0 11 3 0 0 22 16 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 27 18 {0 0 0} 0 1 0 2 {0 0 0} 0 2 14 15 {0 0 0} 0 3 3 10 {0 0 0} 0 4 1 6 {0 0 0} 0 5 26 17 {0 0 0} 0 6 7 2 {0 0 0} 0 7 8 2 {0 0 0} 0 8 16 21 {0 0 0} 0 9 28 18 {0 0 0} 0 10 9 2 {0 0 0} 0 11 15 20 {0 0 0} 0 12 15 19 {0 0 0} 0 13 0 1 {0 0 0} 0 14 4 1 {0 0 0} 0 15 1 5 {0 0 0} 0 16 17 25 {0 0 0} 0 17 15 18 {0 0 0} 0 18 4 13 {0 0 0} 0 19 3 0 {0 0 0} 0 20 16 14 {0 0 0} 0 21 14 17 {0 0 0} 0 22 3 12 {0 0 0} 0 23 17 24 {0 0 0} 0 24 16 23 {0 0 0} 0 25 11 3 {0 0 0} 0 26 22 16 {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