./iterations/neb0_image09_iter144.sci output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)

Status: finished
#MD System 2.0

@Title neb0_image09

@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
8 {} {0.472151828625 0.216068769105 0.494512344216} O1 1 1
14 {} {0.334299050691 0.215933395251 0.583753679664} Si1 2 1
14 {} {0.604373336505 0.299312430186 0.44436441} Si2 3 1
8 {} {0.565634821888 0.45288328839 0.400121515786} O2 4 1
8 {} {0.325597653167 0.350797384181 0.677851070607} O3 5 1
14 {} {0.298499147743 0.513295710516 0.671999588956} Si3 6 1
14 {} {0.50907205711 0.598226556289 0.451726001636} Si4 7 1
1 {} {0.337150528358 0.0976086433138 0.673520566489} H1 8 1
1 {} {0.217843712305 0.212117709838 0.490498452557} H2 9 1
1 {} {0.65934882627 0.229605726322 0.325709745033} H3 10 1
1 {} {0.703011201819 0.304824728703 0.555623675441} H4 11 1
1 {} {0.153045444512 0.540516155988 0.656626422831} H5 12 1
1 {} {0.354220293253 0.571109022998 0.797148082339} H6 13 1
1 {} {0.321362321744 0.894470747685 0.419399235937} H7 14 1
1 {} {0.473246890154 0.677620451578 0.332021725782} H8 15 1
1 {} {0.612998624133 0.664463617579 0.534949189674} H10 16 1
8 {} {0.372559355285 0.58027861801 0.542280151554} O 17 1
1 {} {0.29567103859 0.853384985269 0.47895199336} H14 18 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} {10 10 10 90 90 90} {{1 0 0} {0 1 0} {0 0 1}} {{1 0 0} {0 1 0} {0 0 1}} P1 1 {{10 0 0} {0 10 0} {0 0 10}} {{0.1 0 0} {0 0.1 0} {0 0 0.1}}
@end
@Columns AsymmetricBond
	Atom1	reference	AsymmetricAtom
	Atom2	reference	AsymmetricAtom
	Key	int	0
	Order	int	0
@end
@data
12 5 0 0
1 0 0 0
2 0 0 0
14 6 0 0
16 5 0 0
15 6 0 0
16 6 0 0
4 1 0 0
3 2 0 0
11 5 0 0
7 1 0 0
8 1 0 0
6 3 0 0
5 4 0 0
10 2 0 0
9 2 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 12 5 {0 0 0} 0
1 0 1 {0 0 0} 0
2 0 2 {0 0 0} 0
3 14 6 {0 0 0} 0
4 16 5 {0 0 0} 0
5 15 6 {0 0 0} 0
6 16 6 {0 0 0} 0
7 4 1 {0 0 0} 0
8 3 2 {0 0 0} 0
9 5 11 {0 0 0} 0
10 7 1 {0 0 0} 0
11 8 1 {0 0 0} 0
12 6 3 {0 0 0} 0
13 5 4 {0 0 0} 0
14 10 2 {0 0 0} 0
15 9 2 {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