./iterations/neb0_image08_iter100.sci output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)

Status: finished
#MD System 2.0

@Title neb0_image08

@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 {} {0.471401477894 0.21929912895 0.489764253938} O1 1 1
14 {} {0.33264921014 0.220735673416 0.577733403976} Si1 2 1
14 {} {0.603001417686 0.307093708985 0.444745763695} Si2 3 1
8 {} {0.561499556069 0.459628578305 0.400892565295} O2 4 1
8 {} {0.328381448724 0.351669539371 0.678061430233} O3 5 1
14 {} {0.299017849982 0.51346681436 0.675679184914} Si3 6 1
14 {} {0.50509372959 0.604588663683 0.453374242233} Si4 7 1
1 {} {0.329449982896 0.0993148748247 0.662650880117} H1 8 1
1 {} {0.217624115023 0.22705109098 0.483328005783} H2 9 1
1 {} {0.663339231222 0.243653935164 0.32510122226} H3 10 1
1 {} {0.697707327352 0.314013728119 0.559689237418} H4 11 1
1 {} {0.152445905089 0.538440291797 0.66577842707} H5 12 1
1 {} {0.356550851477 0.570430429634 0.800640297064} H6 13 1
1 {} {0.33287657134 0.848813327118 0.418605201153} H7 14 1
1 {} {0.473481636029 0.683145828895 0.332145516737} H8 15 1
1 {} {0.608715886879 0.671595108046 0.536899834676} H10 16 1
8 {} {0.369374141194 0.583530864955 0.54474579021} O 17 1
1 {} {0.307475802288 0.816046393734 0.481222696945} 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