#MD System 2.0 @Title neb0_image03 @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 {} {0.459402597266 0.262890764408 0.493457648352} O1 1 1 14 {} {0.324741441851 0.236574875608 0.582104974776} Si1 2 1 14 {} {0.58317454654 0.349842470056 0.431514947912} Si2 3 1 8 {} {0.530049339444 0.49357506777 0.371877580687} O2 4 1 8 {} {0.307109415558 0.35020693904 0.699865796232} O3 5 1 14 {} {0.261213443913 0.503488473026 0.732968784991} Si3 6 1 14 {} {0.559390507297 0.655810218196 0.363346370998} Si4 7 1 1 {} {0.338838075419 0.104785318369 0.648590198217} H1 8 1 1 {} {0.206040014519 0.239506482743 0.49224347071} H2 9 1 1 {} {0.639847201505 0.270407576997 0.31916853386} H3 10 1 1 {} {0.683555261348 0.375397891147 0.53932415663} H4 11 1 1 {} {0.11276921557 0.514608630582 0.73017312234} H5 12 1 1 {} {0.318160202667 0.536374030936 0.865219023154} H6 13 1 1 {} {0.43311953059 0.725845139052 0.325607518556} H7 14 1 1 {} {0.661873772199 0.681404092401 0.256859067824} H8 15 1 1 {} {0.6088032118 0.707876559571 0.494400514842} H10 16 1 8 {} {0.323439779692 0.611032012764 0.621292830498} O 17 1 1 {} {0.258558650232 0.652891512919 0.563043249991} 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