./iterations/neb0_image09_iter298.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 {} {0.472610539694 0.210262690758 0.495647384082} O1 1 1
14 {} {0.333412423804 0.214476474813 0.583032774881} Si1 2 1
14 {} {0.606850040477 0.292064917557 0.448184348777} Si2 3 1
8 {} {0.571022797647 0.448629313189 0.41484324193} O2 4 1
8 {} {0.323101034235 0.35363863518 0.669371083445} O3 5 1
14 {} {0.3002687295 0.516467648408 0.668641182943} Si3 6 1
14 {} {0.512527384133 0.597179553379 0.45185961756} Si4 7 1
1 {} {0.334177275894 0.10161634816 0.67957486774} H1 8 1
1 {} {0.219193872686 0.205899821803 0.487837528378} H2 9 1
1 {} {0.657619378501 0.229169482456 0.323519385176} H3 10 1
1 {} {0.70765599831 0.287502362215 0.558012528254} H4 11 1
1 {} {0.154973552692 0.546346683356 0.660650152856} H5 12 1
1 {} {0.361447769679 0.57005357912 0.792954724314} H6 13 1
1 {} {0.312410930984 0.918766525442 0.438837136593} H7 14 1
1 {} {0.481674000014 0.667249244339 0.324741905754} H8 15 1
1 {} {0.613601624774 0.670364620278 0.533564751982} H10 16 1
8 {} {0.372223145856 0.58431310108 0.537504257718} O 17 1
1 {} {0.275315761745 0.858516850413 0.462280793053} 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