#MD System 2.0 @Title neb0_image02 @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 {} {0.262380763053 0.47957717175 0.522413299366} N1 1 1 14 {} {0.331219423591 0.594579588278 0.542665895181} Si1 2 1 14 {} {0.147270793656 0.490188205806 0.498345667503} Si2 3 1 14 {} {0.307388680718 0.344526114692 0.527397032492} Si3 4 1 8 {} {0.404061725767 0.614098015401 0.439896119051} O 5 1 1 {} {0.272568808661 0.694099873189 0.556036190206} H1 6 1 1 {} {0.390327256431 0.575377728914 0.640452408987} H2 7 1 1 {} {0.122983393552 0.610743855887 0.495634245008} H3 8 1 1 {} {0.0961212259892 0.432935228619 0.588434778413} H4 9 1 1 {} {0.122879746121 0.4375652978 0.389597138889} H5 10 1 1 {} {0.369652861217 0.323919835133 0.432384515474} H6 11 1 1 {} {0.231426627559 0.264361694802 0.519464041784} H7 12 1 1 {} {0.357019349548 0.326732005335 0.633808105379} H8 13 1 1 {} {0.381002815853 0.635711427401 0.367338750498} H10 14 1 7 {} {0.770095538533 0.474204590122 0.548194045944} N3 15 1 14 {} {0.730777313487 0.456910144041 0.412014919441} Si4 16 1 14 {} {0.873283444836 0.53542285882 0.575550815692} Si5 17 1 14 {} {0.705630007321 0.423620614091 0.658829932419} Si6 18 1 7 {} {0.617845450716 0.4318141582 0.415251295322} N4 19 1 1 {} {0.755506992625 0.559695106521 0.348881069324} H11 20 1 1 {} {0.771724353388 0.357183462039 0.357490245115} H12 21 1 1 {} {0.918031801321 0.558123273602 0.466365703235} H13 22 1 1 {} {0.931652648144 0.459909882935 0.642464915833} H14 23 1 1 {} {0.864500133247 0.642915106985 0.637695623403} H15 24 1 1 {} {0.622285104908 0.489211331013 0.677094855292} H16 25 1 1 {} {0.762228710005 0.434536659915 0.761083168371} H17 26 1 1 {} {0.681351417164 0.303846355584 0.643762424806} H18 27 1 1 {} {0.592933900717 0.360150132618 0.382909584881} H19 28 1 1 {} {0.570283665549 0.491008630343 0.424963788936} 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