MT from job 1251 (LKU-53) GPU (test-2)  
           1
    17.150000   -0.042875    0.000000
    -0.042875   17.150000    0.000000
     0.000000    0.000000   17.150000
   Si   C    O    H 
    69    59    88   164
Direct configuration=     1
   0.03992205  0.08624106  0.99523277
   0.26306095  0.08594196  0.38439244
   0.98391862  0.27535490  0.04009863
   0.31116068  0.24034395  0.29476515
   0.09912335  0.10568773  0.52508764
   0.28108884  0.10478023  0.78470767
   0.09558281  0.27207899  0.61877333
   0.26975611  0.26914841  0.69927613
   0.01771466  0.45967612  0.99160118
   0.25343630  0.41569476  0.35860554
   0.06787181  0.59664997  0.13007265
   0.24540887  0.55322327  0.21931975
   0.08628582  0.37567007  0.46280218
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   0.29645554  0.58182970  0.80816810
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   0.25847600  0.75942313  0.86225318
   0.09384814  0.94366350  0.62537096
   0.27100768  0.92509498  0.72160588
   0.40280662  0.12265113  0.91516530
   0.58209106  0.09300866  0.38142599
   0.41167081  0.30508480  0.17173988
   0.56827653  0.23661530  0.24960733
   0.42394875  0.08479851  0.49169771
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   0.70254385  0.41319365  0.84419124
   0.63511580  0.34691802  0.88667160
Direct configuration=     2
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Direct configuration=     3
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Direct configuration=     4
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Direct configuration=     5
   0.03995837  0.08622619  0.99525774
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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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