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*data for   ICSD #30593
Coll Code   30593
Rec  Date   1980/01/01
Mod  Date   2006/10/01
Chem Name   Molybdenum Nitride (2/1) - Beta
Structured  Mo2 N
Sum         Mo2 N1
ANX         NO2
D(calc)     9.69
Title       Das System Molybdaen-Stickstoff
Author(s)   Ettmayer, P.
Reference   Monatshefte fuer Chemie (-108,1977)
            (1970), 101, 127-140
            Golden Book of Phase Transitions, Wroclaw
            (2002), 1, 1-123
            Acta Crystallographica (1,1948-23,1967)
            (1957), 10, 833-834
Unit Cell   4.2 4.2 8. 90. 90. 90.
Vol         141.12
Z           4
Space Group I 41/a m d S
SG Number   141
Cryst Sys   tetragonal
Pearson     tI12
Wyckoff     e a
Red Cell    I  4.2 4.2 4.981 114.930 114.930 89.999 70.56
Trans Red   1.000 0.000 0.000 / 0.000 -1.000 0.000 / -0.500 0.500 -0.500
Comments    Stable up to 673 K (2nd ref., Tomaszewski), up to 1113 K:
            Fm3-m
            Cell from 3rd ref. (Bezinge et al.): 4.200, 8.010 for Mn2
            N.76
            The structure has been assigned a PDF number: 25-1368
            No R value given in the paper.
            At least one temperature factor missing in the paper.
Atom  #   OX   SITE      x           y           z           SOF      H
Mo   1  +0    8 e   0           0           0.258          1.         0   
N    1  +0    4 a   0           0           0              1.         0   
*end for    ICSD #30593
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