#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 {} {0.464910398214 0.254215197534 0.476905819926} O1 1 1 14 {} {0.327113084031 0.250998386326 0.566342918849} Si1 2 1 14 {} {0.597935713445 0.335987122598 0.427031331866} Si2 3 1 8 {} {0.556658340297 0.476620692077 0.352910423572} O2 4 1 8 {} {0.325320907486 0.377122501364 0.672065822024} O3 5 1 14 {} {0.256193439812 0.513404291887 0.732699368062} Si3 6 1 14 {} {0.537833783462 0.639787580718 0.362761666284} Si4 7 1 1 {} {0.326534636307 0.124257702618 0.644228454923} H1 8 1 1 {} {0.210386791809 0.25971237508 0.473978948218} H2 9 1 1 {} {0.667040779325 0.250489005724 0.327145075243} H3 10 1 1 {} {0.684257047978 0.366942261737 0.544864817248} H4 11 1 1 {} {0.109757199731 0.493866352275 0.750970874799} H5 12 1 1 {} {0.32714947975 0.540576833106 0.861088004453} H6 13 1 1 {} {0.399642551912 0.676700327373 0.319739381357} H7 14 1 1 {} {0.638425199742 0.707304442692 0.276195253441} H8 15 1 1 {} {0.5574400453 0.685475740404 0.504464420181} H10 16 1 8 {} {0.267908040302 0.641120570334 0.628775964208} O 17 1 1 {} {0.355578498819 0.677936465324 0.608889360597} 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