iterations/neb0_image07_iter150.sci output for 44: 750-->752: Si-OH + Si-H , to Si-O-SI + H2 (TSS)

Status: finished

#MD System 2.0

@Title neb0_image07

@Columns AsymmetricAtom
	AtomicNumber	int	0
	Connections	string	{{}}
	Fractional	double	{{0.0 0.0 0.0}}
	Name	string	{{}}
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@data
8 {} {0.471137486274 0.24050815259 0.492837411846} O1 1 1
14 {} {0.332852383936 0.221969039539 0.576536025852} Si1 2 1
14 {} {0.615374134304 0.306700807897 0.451166112389} Si2 3 1
8 {} {0.599329693193 0.469728506491 0.420040916019} O2 4 1
8 {} {0.309564302038 0.349645515565 0.680303952415} O3 5 1
14 {} {0.292158290914 0.512104030525 0.657987760117} Si3 6 1
14 {} {0.496490955965 0.59585350863 0.44066548309} Si4 7 1
1 {} {0.33872830114 0.0990427561453 0.661023509302} H1 8 1
1 {} {0.219597348691 0.215088260728 0.479693066575} H2 9 1
1 {} {0.662929484132 0.234535869201 0.331503585649} H3 10 1
1 {} {0.710728535089 0.284471449048 0.561944461309} H4 11 1
1 {} {0.14698121845 0.547950582031 0.657758048871} H5 12 1
1 {} {0.370477992912 0.586846091124 0.760218497181} H6 13 1
1 {} {0.34956007267 0.882159584239 0.484303886079} H7 14 1
1 {} {0.448324342293 0.661352562265 0.316233746586} H8 15 1
1 {} {0.572402592489 0.69177237888 0.527842910017} H10 16 1
8 {} {0.355045927589 0.549061879761 0.510805050607} O 17 1
1 {} {0.318402942983 0.823726848189 0.520193433294} H14 18 1
@end
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	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}}
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	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}}}
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@data
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@end
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	Atom2	reference	AsymmetricAtom
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	Order	int	0
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@data
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@end
@Columns Bond
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@data
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9 6 3 {0 0 0} 0
10 5 4 {0 0 0} 0
11 10 2 {0 0 0} 0
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@end
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	Criteria	string	{{}}
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	Length	int	1
	Name	string	{{}}
	Table	string	{{}}
	Type	string	atom
	UseColor	int	0
@end
@data
@end