#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 WyckoffPosition int -1 @end @data 8 {} {0.467854088308 0.241413085802 0.473078887444} O1 1 1 14 {} {0.328353846854 0.249069793058 0.55967568197} Si1 2 1 14 {} {0.598354585072 0.331636142601 0.430218252061} Si2 3 1 8 {} {0.551502424006 0.475425827105 0.367274484295} O2 4 1 8 {} {0.331399421692 0.379776432904 0.659115666052} O3 5 1 14 {} {0.263567275098 0.515318293288 0.722705306337} Si3 6 1 14 {} {0.530515816508 0.638271793119 0.373706871215} Si4 7 1 1 {} {0.319649585483 0.12603361273 0.642616945377} H1 8 1 1 {} {0.21333826917 0.259771243636 0.465770720925} H2 9 1 1 {} {0.671337698882 0.256667123791 0.324762243252} H3 10 1 1 {} {0.682344969418 0.356297172721 0.550895765163} H4 11 1 1 {} {0.119587156344 0.489184340819 0.746851698031} H5 12 1 1 {} {0.339786055412 0.546808345354 0.846632381641} H6 13 1 1 {} {0.388255451063 0.670149276017 0.344609251293} H7 14 1 1 {} {0.620023711895 0.703077459273 0.273730295044} H8 15 1 1 {} {0.565873178362 0.690469835205 0.510007018044} H10 16 1 8 {} {0.269044057432 0.644691013036 0.619556357444} O 17 1 1 {} {0.349298552756 0.698457145537 0.61985017327} H14 18 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} {10 10 10 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{10 0 0} {0 10 0} {0 0 10}} {{0.1 0 0} {0 0.1 0} {0 0 0.1}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 12 5 0 0 1 0 0 0 2 0 0 0 16 5 0 0 4 1 0 0 3 2 0 0 17 16 0 0 11 5 0 0 7 1 0 0 8 1 0 0 6 3 0 0 5 4 0 0 10 2 0 0 9 2 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 12 5 {0 0 0} 0 1 0 1 {0 0 0} 0 2 0 2 {0 0 0} 0 3 16 5 {0 0 0} 0 4 4 1 {0 0 0} 0 5 3 2 {0 0 0} 0 6 16 17 {0 0 0} 0 7 5 11 {0 0 0} 0 8 7 1 {0 0 0} 0 9 8 1 {0 0 0} 0 10 6 3 {0 0 0} 0 11 5 4 {0 0 0} 0 12 10 2 {0 0 0} 0 13 9 2 {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