./neb0_image06_initial.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 {} {0.470223943973 0.226153776456 0.487379099628} O1 1 1
14 {} {0.332909459038 0.230073357199 0.57710468823} Si1 2 1
14 {} {0.603884946924 0.308651081022 0.439916956368} Si2 3 1
8 {} {0.565370471047 0.458151066155 0.385742205439} O2 4 1
8 {} {0.327623325185 0.365828356769 0.668383044033} O3 5 1
14 {} {0.28185631795 0.512616882607 0.694278300007} Si3 6 1
14 {} {0.519379108681 0.611157569397 0.414202442093} Si4 7 1
1 {} {0.333585124781 0.114151355535 0.668387004278} H1 8 1
1 {} {0.216968518351 0.227414637968 0.48519932951} H2 9 1
1 {} {0.664337751147 0.234262358958 0.327855622881} H3 10 1
1 {} {0.69667887096 0.321558061651 0.554682958185} H4 11 1
1 {} {0.136788444175 0.514858516321 0.693415766324} H5 12 1
1 {} {0.34425724217 0.556511430939 0.819223085809} H6 13 1
1 {} {0.345158021702 0.820693192377 0.377235392302} H7 14 1
1 {} {0.538747735864 0.685483851018 0.303162989855} H8 15 1
1 {} {0.588912872478 0.673307108654 0.520170628898} H10 16 1
8 {} {0.327333388639 0.607553534196 0.58066094821} O 17 1
1 {} {0.316070596936 0.804091822778 0.53405753795} 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