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test-Be_missing.xyz@ 1ca493a

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Candidate_v1.7.0 stable

Last change on this file since 1ca493a was b9bfa6, checked in by Frederik Heber <heber@…>, 15 years ago

Changed regression testsuite structure of Selection/Atoms and ../Molecules.

all numbered test cases now have meaningful names.
(Un)Selection/Molecule action renames: by-formula and by-name have plural molecules (they can select multiple ones), by-id is singular.
renamed token of AtomAction/RotateAroundOriginByAngleAction: rotate-origin -> rotate-around-origin.
TESTFIX: Analysis/AngularDipoleCorrelation-Empty due to renaming of molecule_s_-by-formula
TESTFIX: Analysis/SurfaceCorrelation due to renaming of molecule_s_-by_formula

File size: 128 bytes

Line
1	9
2	Created by molecuilder for select-by-element test
3	H 0 0 0
4	He 0 0 1
5	Li 0 1 0
6	B 0 1 2
7	C 0 1 3
8	N 0 1 4
9	O 0 1 5
10	F 0 1 6
11	Ne 0 1 7

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