unknown system                          
           1
     3.908000    0.000000    0.000000
     0.000000    3.908000    0.000000
     0.000000    0.000000   80.000000
   Nb   O    Sr   Ti
   6  37  13   6
Direct configuration=     1
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   0.50000000  0.50000000  0.41667754
   0.50000000  0.50000000  0.46776970
   0.50000000  0.00000000  0.36560280
   0.50000000  0.00000000  0.21553886
   0.50000000  0.00000000  0.46777200
   0.50000000  0.50000000  0.24004897
   0.00000000  0.50000000  0.26486180
   0.50000000  0.00000000  0.26486180
   0.00000000  0.50000000  0.46777200
   0.50000000  0.50000000  0.28957670
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   0.00000000  0.50000000  0.21553886
   0.50000000  0.00000000  0.31510498
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   0.50000000  0.00000000  0.11759972
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   0.00000000  0.00000000  0.59440646
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Direct configuration=     2
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   0.50000000 -0.00000000  0.21553732
   0.50000000 -0.00000000  0.46777327
   0.50000000  0.50000000  0.24004970
   0.00000000  0.50000000  0.26486102
   0.50000000 -0.00000000  0.26486102
   0.00000000  0.50000000  0.46777327
   0.50000000  0.50000000  0.28957759
   0.00000000  0.50000000  0.31510603
   0.00000000  0.50000000  0.21553732
   0.50000000  0.00000000  0.31510603
   0.50000000  0.50000000  0.44224170
   0.50000000  0.50000000  0.34001962
   0.00000000  0.50000000  0.36560274
   0.50000000  0.50000000  0.39111003
   0.50000000  0.50000000  0.59586959
   0.50000000  0.50000000  0.19096932
   0.50000000  0.50000000  0.49336191
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   0.50000000  0.50000000  0.99517201
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   0.50000000  0.50000000  0.54479739
   0.50000000  0.50000000  0.04433459
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   0.50000000 -0.00000000  0.06875158
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   0.50000000  0.50000000  0.09316509
   0.00000000  0.50000000  0.11759900
   0.50000000 -0.00000000  0.11759900
   0.50000000  0.00000000  0.51906753
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   0.50000000  0.50000000  0.14202986
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   0.50000000  0.00000000  0.16653707
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  -0.00000000  0.00000000  0.54431489
   0.00000000  0.00000000  0.99781345
  -0.00000000  0.00000000  0.39099405
   0.00000000  0.00000000  0.33943332
   0.00000000  0.00000000  0.59441344
   0.00000000  0.00000000  0.23864379
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   0.00000000 -0.00000000  0.14149290
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   0.50000000  0.50000000  0.26345175
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   0.50000000  0.50000000  0.16580590
   0.50000000  0.50000000  0.11703237
   0.50000000  0.50000000  0.06827454
   0.50000000  0.50000000  0.01894081
Direct configuration=     3
   0.50000000  0.50000000  0.57055620
   0.50000000  0.50000000  0.31414465
   0.50000000  0.50000000  0.36545956
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   0.50000000  0.50000000  0.41667966
   0.50000000  0.50000000  0.46776597
   0.50000000 -0.00000000  0.36560261
   0.50000000 -0.00000000  0.21553391
   0.50000000 -0.00000000  0.46777608
   0.50000000  0.50000000  0.24005131
   0.00000000  0.50000000  0.26485928
   0.50000000 -0.00000000  0.26485928
   0.00000000  0.50000000  0.46777608
   0.50000000  0.50000000  0.28957955
   0.00000000  0.50000000  0.31510836
   0.00000000  0.50000000  0.21553391
   0.50000000  0.00000000  0.31510836
   0.50000000  0.50000000  0.44224554
   0.50000000  0.50000000  0.34002064
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   0.50000000  0.50000000  0.14203133
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   0.50000000  0.00000000  0.16653860
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  -0.00000000 -0.00000000  0.49336566
  -0.00000000  0.00000000  0.54431279
   0.00000000  0.00000000  0.99778500
  -0.00000000  0.00000000  0.39099047
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   0.00000000  0.00000000  0.59442892
   0.00000000  0.00000000  0.23864299
   0.00000000 -0.00000000  0.19013825
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   0.50000000  0.50000000  0.26345182
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   0.50000000  0.50000000  0.06827391
   0.50000000  0.50000000  0.01890232
Direct configuration=     4
   0.50000000  0.50000000  0.57055623
   0.50000000  0.50000000  0.31414423
   0.50000000  0.50000000  0.36545953
   0.50000000  0.50000000  0.51908088
   0.50000000  0.50000000  0.41667975
   0.50000000  0.50000000  0.46776582
   0.50000000 -0.00000000  0.36560260
   0.50000000 -0.00000000  0.21553370
   0.50000000 -0.00000000  0.46777625
   0.50000000  0.50000000  0.24005141
   0.00000000  0.50000000  0.26485918
   0.50000000 -0.00000000  0.26485918
   0.00000000  0.50000000  0.46777625
   0.50000000  0.50000000  0.28957967
   0.00000000  0.50000000  0.31510850
   0.00000000  0.50000000  0.21553370
   0.50000000  0.00000000  0.31510850
   0.50000000  0.50000000  0.44224577
   0.50000000  0.50000000  0.34002070
   0.00000000  0.50000000  0.36560260
   0.50000000  0.50000000  0.39110529
   0.50000000  0.50000000  0.59586094
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   0.50000000  0.50000000  0.49336763
   0.50000000 -0.00000000  0.57034258
   0.50000000  0.50000000  0.99521524
  -0.00000000  0.50000000  0.01967211
   0.50000000  0.00000000  0.01967211
   0.00000000  0.50000000  0.57034258
   0.50000000  0.50000000  0.54479737
   0.50000000  0.50000000  0.04434275
   0.00000000  0.50000000  0.06875365
   0.50000000 -0.00000000  0.06875365
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   0.50000000  0.50000000  0.09316341
   0.00000000  0.50000000  0.11759729
   0.50000000 -0.00000000  0.11759729
   0.50000000  0.00000000  0.51906934
   0.00000000  0.50000000  0.51906934
   0.50000000  0.50000000  0.14203141
   0.00000000  0.50000000  0.16653869
   0.50000000  0.00000000  0.16653869
  -0.00000000  0.50000000  0.41669170
  -0.00000000 -0.00000000  0.49336562
  -0.00000000  0.00000000  0.54431267
   0.00000000  0.00000000  0.99778328
  -0.00000000  0.00000000  0.39099025
   0.00000000  0.00000000  0.33943239
   0.00000000  0.00000000  0.59442986
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   0.50000000  0.50000000  0.01889999
Direct configuration=     5
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   0.50000000  0.50000000  0.36545947
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   0.50000000  0.50000000  0.46776551
   0.50000000 -0.00000000  0.36560258
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   0.50000000 -0.00000000  0.26485897
   0.00000000  0.50000000  0.46777659
   0.50000000  0.50000000  0.28957990
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   0.50000000  0.00000000  0.31510879
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   0.50000000  0.50000000  0.99522017
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   0.50000000  0.00000000  0.16653887
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Direct configuration=     6
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Direct configuration=     7
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Direct configuration=     8
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Direct configuration=     9
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Direct configuration=    10
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Direct configuration=    11
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Direct configuration=    12
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Direct configuration=    13
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Direct configuration=    14
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Direct configuration=    15
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Direct configuration=    16
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Direct configuration=    17
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Direct configuration=    18
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Direct configuration=    19
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Direct configuration=    20
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Direct configuration=    21
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Direct configuration=    22
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Direct configuration=    23
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Direct configuration=    24
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Direct configuration=    25
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Direct configuration=    26
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Direct configuration=    27
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Direct configuration=    28
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Direct configuration=    29
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Direct configuration=    30
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Direct configuration=    31
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Direct configuration=    32
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Direct configuration=    33
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Direct configuration=    34
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Direct configuration=    35
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Direct configuration=    36
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Direct configuration=    37
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Direct configuration=    38
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Direct configuration=    39
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Direct configuration=    40
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Direct configuration=    41
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Direct configuration=    42
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Direct configuration=    43
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Direct configuration=    44
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Direct configuration=    45
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Direct configuration=    46
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Direct configuration=    47
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