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Type_2 Test for short non-bonding inter H..H contacts

Short intermolecular H..H contacts may indicate incorrectly determined
structures (i.e. wrong symmetry, missed translation symmetry, wrong position
with reference to the symmetry elements, hydrogen atoms on atoms where there
should not be any  etc..)
Short intermolecular contacts may be indicative for inconsistent symmetry
data (e.g. coordinates for space-group P43 and symmetry specified as P41 or
P21/n & P21/c confusions). Short contacts are defined using a van der Waals
radius of 1.2 Angstrom. For intermolecular contacts, an alert is generated
for contacts less than 2.4 Angstrom.
4Â¥2008-06-04 22:26:13
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lanmao20

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2Â¥2008-06-04 08:23:32
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biyanfeng

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