./iterations/neb0_image02_iter29.sci output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)

Status: finished
#MD System 2.0

@Title neb0_image02

@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 {} {0.468622676143 0.238563255361 0.47462238365} O1 1 1
14 {} {0.330151137045 0.245931036373 0.56165579551} Si1 2 1
14 {} {0.597115324739 0.331325336959 0.431939640162} Si2 3 1
8 {} {0.544167248346 0.476012701863 0.374030922867} O2 4 1
8 {} {0.333380444057 0.378097819977 0.66002237004} O3 5 1
14 {} {0.270451508861 0.518614702575 0.717508310111} Si3 6 1
14 {} {0.529275259346 0.640695672515 0.378394560879} Si4 7 1
1 {} {0.321266665312 0.122530811648 0.645147436716} H1 8 1
1 {} {0.214516240688 0.253749614903 0.467936434363} H2 9 1
1 {} {0.669491230919 0.252376784889 0.329447523373} H3 10 1
1 {} {0.68530033012 0.346731957207 0.55087018623} H4 11 1
1 {} {0.125184149027 0.498089969138 0.736554330704} H5 12 1
1 {} {0.341282693491 0.543094855989 0.846855520797} H6 13 1
1 {} {0.388196328101 0.682909988823 0.357226852498} H7 14 1
1 {} {0.609312866426 0.702631298753 0.268410836114} H8 15 1
1 {} {0.565801297342 0.686407293133 0.515407323628} H10 16 1
8 {} {0.281719470763 0.637834994493 0.60437834038} O 17 1
1 {} {0.334851276274 0.71691987039 0.610649220141} 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 2
15 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 4 1 {0 0 0} 0
7 3 2 {0 0 0} 0
8 5 11 {0 0 0} 0
9 7 1 {0 0 0} 0
10 8 1 {0 0 0} 0
11 6 3 {0 0 0} 0
12 5 4 {0 0 0} 0
13 10 2 {0 0 0} 0
14 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