#MD System 2.0 @Title neb0_image00 @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 {} {0.250578425469 0.488410555357 0.523410654306} N1 1 1 14 {} {0.319235995249 0.603288439946 0.544023678346} Si1 2 1 14 {} {0.135393890317 0.498956214851 0.499377238157} Si2 3 1 14 {} {0.295579084628 0.353221553473 0.528477829935} Si3 4 1 8 {} {0.392234407804 0.622944076286 0.440826339172} O 5 1 1 {} {0.260759807899 0.702880295303 0.557022604889} H1 6 1 1 {} {0.378506332099 0.584154474387 0.641487338853} H2 7 1 1 {} {0.111149178723 0.619521442975 0.496700338778} H3 8 1 1 {} {0.08423941361 0.441682003041 0.589545010138} H4 9 1 1 {} {0.111056299007 0.446334638048 0.390648231636} H5 10 1 1 {} {0.357814575731 0.332708404342 0.433431747528} H6 11 1 1 {} {0.219570666317 0.273122658537 0.520489959576} H7 12 1 1 {} {0.345190318066 0.33550643398 0.634872518465} H8 13 1 1 {} {0.369176717119 0.644500420933 0.36833072258} H10 14 1 7 {} {0.781184747396 0.466013137359 0.547298603351} N3 15 1 14 {} {0.741657863916 0.448599532898 0.410979354801} Si4 16 1 14 {} {0.884335409733 0.527248286344 0.574482459937} Si5 17 1 14 {} {0.716677584691 0.415474741612 0.657788709553} Si6 18 1 7 {} {0.629183393357 0.423504284546 0.414257896552} N4 19 1 1 {} {0.766561536796 0.551558854843 0.347881518034} H11 20 1 1 {} {0.782817930587 0.348988899544 0.35650516604} H12 21 1 1 {} {0.929068344591 0.549943717211 0.465389224055} H13 22 1 1 {} {0.942770564607 0.451693194337 0.641511489518} H14 23 1 1 {} {0.875547873624 0.634747830997 0.636733462998} H15 24 1 1 {} {0.633324383505 0.481029943126 0.676137759722} H16 25 1 1 {} {0.773287804587 0.426358562573 0.760126207695} H17 26 1 1 {} {0.692381554369 0.29563740681 0.642771747341} H18 27 1 1 {} {0.604014709953 0.351945499653 0.381915169937} H19 28 1 1 {} {0.581135136687 0.482992844577 0.423997588517} 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