./iterations/neb0_image08_iter28.sci output for 40: 572-->565: F2 + F3Si-NF-SiF3, to SiF4 + F3Si-NF2 (TSS)

Status: finished

#MD System 2.0

@Title neb0_image08

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	AtomicNumber	int	0
	Connections	string	{{}}
	Fractional	double	{{0.0 0.0 0.0}}
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@data
14 {} {0.315737122952 0.760109144053 0.523685696401} Si1 1 1
7 {} {0.424222293719 0.611622851667 0.520388804381} N 2 1
14 {} {0.337102706823 0.323299355683 0.537080826421} Si2 3 1
9 {} {0.3168614009 0.851643598335 0.395895352482} F1 4 1
9 {} {0.38649393506 0.837646591872 0.641015846806} F2 5 1
9 {} {0.168836071198 0.728711058012 0.569960532734} F3 6 1
9 {} {0.241959511537 0.440815386349 0.604922387118} F4 7 1
9 {} {0.317717478216 0.199134906736 0.637888216695} F5 8 1
9 {} {0.543983827626 0.670815001653 0.480943244794} F7 9 1
9 {} {0.270973848661 0.300130248195 0.390296419286} F8 10 1
9 {} {0.403277260284 0.516753979671 0.409272182251} F9 11 1
9 {} {0.497238261009 0.332069674626 0.535921227741} F10 12 1
@end
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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
{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}}
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@data
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@data
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@data
@end