iterations/neb0_image02_iter65.sci output for 745: 733-->741: H2O near HO-Si on SiO2 surface --> H-OSi + OH-Si on SiO2 surface (TSS)

Status: running
#MD System 2.0

@Title neb0_image02

@Columns AsymmetricAtom
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	Connections	string	{{}}
	Fractional	double	{{0.0 0.0 0.0}}
	Freeze	int	0
	Name	string	{{}}
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	Spin	double	0.0
	WyckoffPosition	int	-1
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@data
14 {} {0.128209070413 0.127878216638 0.385805960486} 7 Si1 1 0.0 1
14 {} {0.373878220413 0.121776766638 0.306941700486} 7 Si2 2 0.0 1
14 {} {0.30114917721 0.087443556536 0.608143549181} 0 Si3 3 0.0 1
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14 {} {0.0935841204135 0.379775786638 0.462357350486} 7 Si5 5 0.0 1
14 {} {0.351627540413 0.368663686638 0.228419640486} 7 Si6 6 0.0 1
14 {} {0.345105338866 0.344608623016 0.536093279521} 0 Si7 7 0.0 1
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8 {} {0.2978052561 0.185807951366 0.551446915961} 0 O4 11 0.0 1
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8 {} {0.156230530413 0.276387876638 0.414780930486} 7 O6 13 0.0 1
8 {} {0.418217110413 0.489394396638 0.267683350486} 7 O7 14 0.0 1
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8 {} {0.895815472681 0.230770969846 0.658827885176} 0 O16 23 0.0 1
14 {} {0.129014380413 0.629002676638 0.381764090486} 7 Si8 24 0.0 1
14 {} {0.379771060413 0.622072666638 0.306452210486} 7 Si9 25 0.0 1
14 {} {0.334418409547 0.589124246283 0.618905339136} 0 Si10 26 0.0 1
14 {} {0.113674940413 0.893836366638 0.146373460486} 7 Si11 27 0.0 1
14 {} {0.0884462304135 0.873807896638 0.463354090486} 7 Si12 28 0.0 1
14 {} {0.359778970413 0.869567416638 0.228284980486} 7 Si13 29 0.0 1
14 {} {0.347337989374 0.837153306174 0.539428922544} 0 Si14 30 0.0 1
8 {} {0.0508352804135 0.520153606638 0.109506800486} 7 O17 31 0.0 1
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8 {} {0.922092805665 0.535848710574 0.679719104205} 0 O31 45 0.0 1
14 {} {0.624954360413 0.171013626638 0.386519890486} 7 Si15 46 0.0 1
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14 {} {0.632333060413 0.676639456638 0.384935890486} 7 Si22 69 0.0 1
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14 {} {0.857158160413 0.848123596638 0.226225730486} 7 Si27 74 0.0 1
14 {} {0.84285026261 0.856135441732 0.544462523785} 0 Si28 75 0.0 1
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1 {} {0.103209170413 0.111891676638 0.107252070486} 7 H1 92 0.0 1
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1 {} {0.0959973704135 0.611930836638 0.109547030486} 7 H3 94 0.0 1
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14 {} {0.966222782087 0.386340655008 0.651100956619} 0 Si29 100 0.0 1
14 {} {0.543515182872 0.213418683578 0.647348006544} 0 Si30 101 0.0 1
8 {} {0.572462342725 0.342758675352 0.688801257108} 0 O64 102 0.0 1
14 {} {0.571448331164 0.510626015498 0.692670077519} 0 Si31 103 0.0 1
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@data
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