#MD System 2.0 @Title neb0_image05 @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 {} {0.469028027657 0.28228818128 0.494025265994} O1 1 1 14 {} {0.326084954154 0.236297861579 0.558489534222} Si1 2 1 14 {} {0.61744635286 0.349040527254 0.474497209358} Si2 3 1 8 {} {0.613430184171 0.504260558004 0.528450288007} O2 4 1 8 {} {0.245969881471 0.365663369765 0.621231896422} O3 5 1 14 {} {0.229348144557 0.52669914263 0.648290823847} Si3 6 1 14 {} {0.57987872351 0.654324017245 0.466811814043} Si4 7 1 1 {} {0.346088736096 0.139658015029 0.670069605878} H1 8 1 1 {} {0.243566086451 0.178911098677 0.448036332252} H2 9 1 1 {} {0.64678200303 0.34968858164 0.330126468096} H3 10 1 1 {} {0.714686558704 0.273784162169 0.557371817096} H4 11 1 1 {} {0.12234835341 0.555386586925 0.746846009194} H5 12 1 1 {} {0.361718518129 0.565698435905 0.703004017545} H6 13 1 1 {} {0.549034562464 0.74644241516 0.578713161827} H7 14 1 1 {} {0.462157769819 0.647367859147 0.376467255839} H8 15 1 1 {} {0.695798462369 0.702107969413 0.386902368147} H10 16 1 8 {} {0.183355226337 0.612861524808 0.515348212413} O 17 1 1 {} {0.203363532972 0.582037858996 0.42637616693} 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 1 0 0 0 2 0 0 0 14 6 0 0 16 5 0 2 15 6 0 0 4 1 0 0 3 2 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 0 1 {0 0 0} 0 1 0 2 {0 0 0} 0 2 14 6 {0 0 0} 0 3 16 5 {0 0 0} 0 4 15 6 {0 0 0} 0 5 4 1 {0 0 0} 0 6 3 2 {0 0 0} 0 7 7 1 {0 0 0} 0 8 8 1 {0 0 0} 0 9 6 3 {0 0 0} 0 10 5 4 {0 0 0} 0 11 10 2 {0 0 0} 0 12 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