#MD System 2.0 @Title neb0_image06 @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 7 {} {0.286024972597 0.462035659812 0.520391035153} N1 1 1 14 {} {0.354646118063 0.576906531911 0.540936750847} Si1 2 1 14 {} {0.17090805276 0.472677286184 0.496104616994} Si2 3 1 14 {} {0.331192506366 0.326964759558 0.525298134317} Si3 4 1 8 {} {0.427629288356 0.596937446531 0.437833460827} O 5 1 1 {} {0.29627074887 0.676483115086 0.554088714295} H1 6 1 1 {} {0.414040722254 0.557780386119 0.638216634798} H2 7 1 1 {} {0.146740684252 0.593249085329 0.49332040724} H3 8 1 1 {} {0.119770628655 0.415445005675 0.586183980419} H4 9 1 1 {} {0.146636743759 0.419887329254 0.38750359092} H5 10 1 1 {} {0.393337377329 0.306215210361 0.430213720796} H6 11 1 1 {} {0.255297481462 0.24684615786 0.51754418495} H7 12 1 1 {} {0.380794132791 0.309139953305 0.631617048069} H8 13 1 1 {} {0.404677617785 0.618260785362 0.365261115177} H10 14 1 7 {} {0.748008976779 0.490614975208 0.550246143429} N3 15 1 14 {} {0.708535648543 0.473110424514 0.413995874401} Si4 16 1 14 {} {0.85110503925 0.551887815925 0.57738374604} Si5 17 1 14 {} {0.683487491458 0.440082899204 0.660660624574} Si6 18 1 7 {} {0.596114995477 0.447985993757 0.41716431267} N4 19 1 1 {} {0.733442975829 0.575981054987 0.350953875092} H11 20 1 1 {} {0.74973499702 0.373698941836 0.35935697794} H12 21 1 1 {} {0.895876161295 0.574643355306 0.468380942565} H13 22 1 1 {} {0.909519213188 0.476329372407 0.644334990015} H14 23 1 1 {} {0.842360747491 0.659262246278 0.639747700715} H15 24 1 1 {} {0.600159849765 0.505556790865 0.679058491628} H16 25 1 1 {} {0.739993909 0.45089633743 0.762999775636} H17 26 1 1 {} {0.659232728937 0.320255154409 0.645856955918} H18 27 1 1 {} {0.570887366351 0.376406278461 0.384906842637} H19 28 1 1 {} {0.548006779068 0.507428007111 0.426859929611} H20 29 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} {15 12 12 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{15 0 0} {0 12 0} {0 0 12}} {{0.0666666666667 0 0} {0 0.0833333333333 0} {0 0 0.0833333333333}} @end @Columns AsymmetricBond Atom1 reference AsymmetricAtom Atom2 reference AsymmetricAtom Key int 0 Order int 0 @end @data 27 18 0 0 2 0 0 0 15 14 0 0 10 3 0 0 6 1 0 0 26 17 0 0 7 2 0 0 8 2 0 0 21 16 0 0 28 18 0 0 9 2 0 0 20 15 0 0 19 15 0 0 1 0 0 0 4 1 0 0 5 1 0 0 25 17 0 0 18 15 0 0 13 4 0 0 3 0 0 0 16 14 0 0 17 14 0 0 12 3 0 0 24 17 0 0 23 16 0 0 11 3 0 0 22 16 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 27 18 {0 0 0} 0 1 0 2 {0 0 0} 0 2 14 15 {0 0 0} 0 3 3 10 {0 0 0} 0 4 1 6 {0 0 0} 0 5 26 17 {0 0 0} 0 6 7 2 {0 0 0} 0 7 8 2 {0 0 0} 0 8 16 21 {0 0 0} 0 9 28 18 {0 0 0} 0 10 9 2 {0 0 0} 0 11 15 20 {0 0 0} 0 12 15 19 {0 0 0} 0 13 0 1 {0 0 0} 0 14 4 1 {0 0 0} 0 15 1 5 {0 0 0} 0 16 17 25 {0 0 0} 0 17 15 18 {0 0 0} 0 18 4 13 {0 0 0} 0 19 3 0 {0 0 0} 0 20 16 14 {0 0 0} 0 21 14 17 {0 0 0} 0 22 3 12 {0 0 0} 0 23 17 24 {0 0 0} 0 24 16 23 {0 0 0} 0 25 11 3 {0 0 0} 0 26 22 16 {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