#MD System 2.0 @Title neb0_image04 @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 {} {0.467411318191 0.233343138715 0.488688260644} O1 1 1 14 {} {0.329287148733 0.228868263535 0.577526571499} Si1 2 1 14 {} {0.583480632107 0.339790065654 0.440172849116} Si2 3 1 8 {} {0.517190194057 0.484840624105 0.402955952137} O2 4 1 8 {} {0.322868822962 0.357369661864 0.680745131766} O3 5 1 14 {} {0.279113132611 0.513983053983 0.700780148954} Si3 6 1 14 {} {0.526605752338 0.650389799278 0.401411918782} Si4 7 1 1 {} {0.329281230589 0.104190531774 0.658832565935} H1 8 1 1 {} {0.212801923154 0.233598350127 0.485244727635} H2 9 1 1 {} {0.646652865388 0.283191610237 0.318239053518} H3 10 1 1 {} {0.682712317102 0.350466284117 0.55125583202} H4 11 1 1 {} {0.130864568905 0.531770832347 0.693974758574} H5 12 1 1 {} {0.341097463555 0.560585007458 0.827437784703} H6 13 1 1 {} {0.40268824643 0.733175112449 0.393178908457} H7 14 1 1 {} {0.593244703622 0.681968023261 0.271067203989} H8 15 1 1 {} {0.604951776148 0.699488534421 0.5188047685} H10 16 1 8 {} {0.342848214868 0.603940712066 0.578322683608} O 17 1 1 {} {0.296985792829 0.681558340985 0.54241886348} 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