#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 {} {0.206216028868 0.498259929431 0.563021562481} N1 1 1
14 {} {0.119971536293 0.775905054701 0.658130027132} Si1 2 1
14 {} {0.0842666833728 0.498659118505 0.492465150168} Si2 3 1
14 {} {0.287430854707 0.34584682901 0.55022499924} Si3 4 1
8 {} {0.0272638906801 1.34622592886 0.301713091104} O 5 1
1 {} {0.00900735284439 0.784488144679 0.816805861518} H1 6 1
1 {} {0.288655015982 0.621230449261 0.545414998929} H2 7 1
1 {} {0.103726551054 0.622266973381 0.486450461018} H3 8 1
1 {} {0.0424812651772 0.440614796135 0.602171817591} H4 9 1
1 {} {0.0855690771679 0.433492509602 0.357156847474} H5 10 1
1 {} {0.333420236907 0.327475606704 0.416228874664} H6 11 1
1 {} {0.196796840895 0.253357255645 0.531476963919} H7 12 1
1 {} {0.343017704482 0.337115225501 0.643394217105} H8 13 1
1 {} {0.0788517704144 0.783390992754 0.346795867373} H10 14 1
7 {} {0.837444436887 0.439622262815 0.531754573013} N3 15 1
14 {} {0.898861863798 0.290025356586 0.3808367867} Si4 16 1
14 {} {0.928573674871 0.540174741082 0.586774350136} Si5 17 1
14 {} {0.766056594404 0.399748531153 0.643234655396} Si6 18 1
7 {} {0.819616866256 0.0937862091829 0.420934794199} N4 19 1
1 {} {0.807577460846 0.513908221598 0.35216788904} H11 20 1
1 {} {1.04320205871 0.27413520867 0.278482605381} H12 21 1
1 {} {0.946600007306 0.554270839211 0.460123751457} H13 22 1
1 {} {0.978863516232 0.440748235967 0.652606484277} H14 23 1
1 {} {0.895722654503 0.649992018409 0.653167626905} H15 24 1
1 {} {0.672467334748 0.471305418857 0.680225729941} H16 25 1
1 {} {0.783785696669 0.414519573772 0.753453670545} H17 26 1
1 {} {0.705010288434 0.276136408987 0.651389577824} H18 27 1
1 {} {0.803618853267 0.12633038313 0.303495279112} H19 28 1
1 {} {0.870359383361 0.249934632977 0.446320480402} 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