./iterations/neb0_image06_iter270.sci output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)

Status: finished
#MD System 2.0

@Title neb0_image06

@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 {} {0.470745159606 0.248237428219 0.490144254554} O1 1 1
14 {} {0.325403543328 0.220513102164 0.561006960502} Si1 2 1
14 {} {0.607958342935 0.334598087423 0.469940769078} Si2 3 1
8 {} {0.583087340788 0.489017458897 0.521259810475} O2 4 1
8 {} {0.261935370353 0.353182949886 0.635101598434} O3 5 1
14 {} {0.276949213873 0.516122102359 0.654953890239} Si3 6 1
14 {} {0.493387202149 0.612560948259 0.458009205779} Si4 7 1
1 {} {0.339716851695 0.117647781689 0.667374605499} H1 8 1
1 {} {0.235663725695 0.177825933297 0.451477752331} H2 9 1
1 {} {0.641504988267 0.340179284888 0.323506451619} H3 10 1
1 {} {0.717391278037 0.277231656129 0.552954982228} H4 11 1
1 {} {0.144716944987 0.56034282852 0.712519030489} H5 12 1
1 {} {0.382048569562 0.562888249145 0.749721638491} H6 13 1
1 {} {0.397120191025 0.794188189909 0.504795345805} H7 14 1
1 {} {0.474877619709 0.616275394861 0.311149792803} H8 15 1
1 {} {0.59548008322 0.723833914666 0.478012738442} H10 16 1
8 {} {0.328150081592 0.575863770561 0.508465345478} O 17 1
1 {} {0.333949538154 0.752009043307 0.480664135703} 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
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
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 0 1 {0 0 0} 0
1 0 2 {0 0 0} 0
2 14 6 {0 0 0} 0
3 16 5 {0 0 0} 0
4 15 6 {0 0 0} 0
5 4 1 {0 0 0} 0
6 3 2 {0 0 0} 0
7 7 1 {0 0 0} 0
8 8 1 {0 0 0} 0
9 6 3 {0 0 0} 0
10 5 4 {0 0 0} 0
11 10 2 {0 0 0} 0
12 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