#MD System 2.0

@Title neb1_max2_image01

@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 {} {0.311361160628 0.445516468241 0.517128141654} N1 1 1
14 {} {0.378648274042 0.559750844326 0.542065313112} Si1 2 1
14 {} {0.195700181566 0.455138375746 0.494286754828} Si2 3 1
14 {} {0.355546468803 0.309627892647 0.523512026767} Si3 4 1
8 {} {0.447161325029 0.580961929122 0.437546137206} O 5 1
1 {} {0.322178876033 0.655964040732 0.550686094867} H1 6 1
1 {} {0.437320664182 0.5404892143 0.634134645282} H2 7 1
1 {} {0.170871197487 0.575031665303 0.491282588532} H3 8 1
1 {} {0.14381722217 0.39713244455 0.58439705747} H4 9 1
1 {} {0.170709854076 0.401794238802 0.384971013029} H5 10 1
1 {} {0.417594854391 0.28837858074 0.428035099742} H6 11 1
1 {} {0.279235845705 0.228589161523 0.515147154788} H7 12 1
1 {} {0.404981185384 0.291182047472 0.629381389185} H8 13 1
1 {} {0.429062419344 0.600582082967 0.362000063318} H10 14 1
7 {} {0.724898734684 0.507099193433 0.551551604814} N3 15 1
14 {} {0.685105340168 0.488751254799 0.415724407041} Si4 16 1
14 {} {0.827908954707 0.568263691672 0.579137726862} Si5 17 1
14 {} {0.661535448682 0.457087994296 0.662453728336} Si6 18 1
7 {} {0.576530522206 0.462520877327 0.418713947027} N4 19 1
1 {} {0.710613962509 0.592244120909 0.353152740383} H11 20 1
1 {} {0.726563954191 0.391672794451 0.362223561369} H12 21 1
1 {} {0.873385821207 0.591424190878 0.47033364208} H13 22 1
1 {} {0.88729700231 0.492992726073 0.646750075485} H14 23 1
1 {} {0.819792330791 0.676413244376 0.641892056489} H15 24 1
1 {} {0.577409681329 0.522520728339 0.681138113746} H16 25 1
1 {} {0.717425966926 0.467664106499 0.765223326622} H17 26 1
1 {} {0.636477884218 0.336829902663 0.647772344871} H18 27 1
1 {} {0.548634140119 0.395602507848 0.387809089817} H19 28 1
1 {} {0.526664673098 0.52174202605 0.427970714052} 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