#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 7 {} {0.280121794853 0.466589251411 0.520979778558} N1 1 1 14 {} {0.34897813913 0.581314535309 0.541206318361} Si1 2 1 14 {} {0.164991871669 0.477230486349 0.496733944939} Si2 3 1 14 {} {0.325150925878 0.331434783456 0.52577164316} Si3 4 1 8 {} {0.42227316367 0.600509429811 0.438195535313} O 5 1 1 {} {0.290367366484 0.680773013246 0.554574016818} H1 6 1 1 {} {0.407975050626 0.56222084944 0.638753096764} H2 7 1 1 {} {0.140694683973 0.597727320924 0.49389339446} H3 8 1 1 {} {0.113773469775 0.419939429634 0.586691393567} H4 9 1 1 {} {0.140600693787 0.424440979795 0.388150076362} H5 10 1 1 {} {0.387341910784 0.310655436181 0.430738164597} H6 11 1 1 {} {0.249258161805 0.251282926939 0.518064604669} H7 12 1 1 {} {0.374706443625 0.313606574536 0.63207844858} H8 13 1 1 {} {0.398833128251 0.62255099267 0.365994722732} H10 14 1 7 {} {0.753570198953 0.486469233642 0.549781360185} N3 15 1 14 {} {0.71401014076 0.469070904744 0.413561245209} Si4 16 1 14 {} {0.856706835925 0.547671092118 0.576877284071} Si5 17 1 14 {} {0.689067333596 0.435953041097 0.660211002608} Si6 18 1 7 {} {0.601437044506 0.444119188551 0.416667805928} N4 19 1 1 {} {0.73901709785 0.571846557706 0.350428408617} H11 20 1 1 {} {0.755056614408 0.369571679868 0.358958726952} H12 21 1 1 {} {0.901481803332 0.570416352546 0.467877962084} H13 22 1 1 {} {0.915086596267 0.472131532739 0.643840690914} H14 23 1 1 {} {0.84795208421 0.655056840616 0.639178007784} H15 24 1 1 {} {0.60572424274 0.501436047675 0.678502855519} H16 25 1 1 {} {0.745628847255 0.446758890348 0.762485833571} H17 26 1 1 {} {0.664879278005 0.316144382937 0.645320861917} H18 27 1 1 {} {0.576234339566 0.372534187193 0.384454722632} H19 28 1 1 {} {0.553514676722 0.503512415516 0.426448650164} 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