;by Peter Hardman, Surface Science Centre, Manchester University
T=0.605 (0.,1.,1.)
O=1.4 (1.,0.,0.)
;
T:  -21.131454    6.639526  -17.637939
O:   -21.461090    6.293823  -19.408966
O:   -20.052124    7.737793  -18.627625
O:   -19.585037    5.126511  -17.630447
O:   -22.677917    8.152466  -17.645462
T:  -21.885391    5.882600  -14.879593
O:   -22.215027    5.536865  -16.650604
O:   -20.806076    6.980881  -15.869278
O:   -20.339005    4.369583  -14.872100
O:   -23.431854    7.395554  -14.887146
T:  -22.639343    5.125641  -12.121277
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O:   -21.559998    6.223969  -13.110992
O:   -21.092911    3.612671  -12.113770
O:   -24.185822    6.638611  -12.128815
T:  -23.393280    4.368759   -9.362930
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O:   -22.313950    5.467041  -10.352600
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O:   -24.939743    5.881714   -9.370468
T:  -24.147232    3.611800   -6.604630
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O:   -23.067917    4.710114   -7.594254
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O:   -25.693695    5.124817   -6.612106
T:  -24.901169    2.854874   -3.846268
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O:   -23.354752    1.341904   -3.838791
O:   -26.447617    4.367905   -3.853821
T:  -25.655106    2.098022   -1.087936
O:   -25.984726    1.752319   -2.858994
O:   -24.575790    3.196259   -2.077637
O:   -24.108704    0.585007   -1.080444
O:   -27.201569    3.610977   -1.095459
T:  -26.409058    1.341049    1.670364
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O:   -25.329727    2.439346    0.680771
O:   -24.862656   -0.171951    1.677872
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T:  -27.162994    0.584152    4.428711
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T:  -27.916946   -0.172760    7.187073
O:   -28.246567   -0.518463    5.416046
O:   -26.837616    0.925476    6.197418
O:   -26.370529   -1.685791    7.194580
O:   -29.463394    1.340179    7.179550
T:  -23.076447    9.289703  -19.028412
T:  -21.337921   11.079376  -16.476028
O:   -21.667542   10.733658  -18.247055
O:   -20.258606   12.177612  -17.465652
O:   -19.791489    9.566406  -16.468506
O:   -22.884384   12.592331  -16.483536
T:  -23.830383    8.532745  -16.270065
T:  -22.091858   10.322464  -13.717712
O:   -22.421494    9.976730  -15.488678
O:   -21.012543   11.420670  -14.707367
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T:  -24.584335    7.775848  -13.511734
T:  -22.845825    9.565521  -10.959381
O:   -23.175446    9.219803  -12.730392
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T:  -25.338287    7.018951  -10.753357
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O:   -23.929398    8.462875   -9.972015
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O:   -25.146179   10.321564   -8.208572
T:  -26.092224    6.261978   -7.995056
T:  -24.353700    8.051682   -5.442657
O:   -24.683319    7.705963   -7.213700
O:   -23.274368    9.149918   -6.432373
O:   -22.807266    6.538712   -5.435196
T:  -26.846161    5.505081   -5.236710
O:   -23.561203    5.781754   -2.676849
T:  -27.600098    4.748169   -2.478455
O:   -24.315155    5.024902    0.081497
T:  -28.354050    3.991241    0.279953
O:   -25.069107    4.267944    2.839783
T:  -29.107986    3.234314    3.038284
O:   -25.823044    3.511017    5.598160
T:  -29.861938    2.477417    5.796616
O:   -26.576981    2.754105    8.356491
T:  -23.282928   13.729538  -17.866440
T:  -21.544388   15.519180  -15.314087
O:   -21.874023   15.173508  -17.085114
O:   -20.465073   16.617462  -16.303787
O:   -19.997971   14.006226  -15.306595
T:  -24.036865   12.972626  -15.108154
T:  -22.298309   14.762283  -12.555771
O:   -22.627930   14.416595  -14.326797
O:   -21.218994   15.860550  -13.545441
O:   -20.751907   13.249329  -12.548309
T:  -24.790802   12.215698  -12.349792
T:  -23.052261   14.005356   -9.797455
O:   -23.381897   13.659668  -11.568451
O:   -21.972946   15.103622  -10.787109
O:   -21.505859   12.492371   -9.789886
T:  -25.544739   11.458771   -9.591446
T:  -23.806198   13.248444   -7.039124
O:   -24.135834   12.902771   -8.810104
O:   -22.726898   14.346695   -8.028778
O:   -22.259796   11.735458   -7.031631
T:  -26.298691   10.701859   -6.833160
T:  -16.693970    6.535889  -16.453445
O:   -17.023605    6.190186  -18.224472
O:   -15.614655    7.634171  -17.443161
O:   -15.147568    5.022888  -16.445969
O:   -18.240417    8.048843  -16.461014
T:  -17.447937    5.778976  -13.695114
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O:   -16.368622    6.877258  -14.684784
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O:   -18.994370    7.291931  -13.702652
T:  -18.201874    5.022018  -10.936813
O:   -18.531479    4.676315  -12.707825
O:   -17.122543    6.120331  -11.926498
O:   -16.655457    3.509033  -10.929306
O:   -19.748306    6.534988  -10.944321
T:  -18.955826    4.265121   -8.178467
O:   -19.285446    3.919449   -9.949432
O:   -17.876511    5.363403   -9.168137
O:   -17.409393    2.752151   -8.170959
O:   -20.502243    5.778091   -8.186005
T:  -19.709763    3.508179   -5.420151
O:   -20.039368    3.162491   -7.191162
O:   -18.630447    4.606491   -6.409821
O:   -18.163345    1.995209   -5.412659
O:   -21.256195    5.021194   -5.427628
T:  -20.463700    2.751251   -2.661819
O:   -20.793320    2.405579   -4.432770
O:   -19.384384    3.849564   -3.651459
O:   -18.917267    1.238266   -2.654327
O:   -22.010132    4.264282   -2.669342
T:  -21.217651    1.994400    0.096512
O:   -21.547226    1.648697   -1.674515
O:   -20.138306    3.092636   -0.893173
O:   -19.671204    0.481384    0.104050
O:   -22.764084    3.507355    0.089005
T:  -21.971588    1.237427    2.854843
O:   -22.301208    0.891739    1.083862
O:   -20.892273    2.335724    1.865204
O:   -20.425140   -0.275574    2.862350
O:   -23.518021    2.750427    2.847336
T:  -22.725540    0.480530    5.613190
O:   -23.055161    0.134827    3.842178
O:   -21.646210    1.578796    4.623535
O:   -21.179092   -1.032471    5.620682
O:   -24.271973    1.993515    5.605667
T:  -23.479462   -0.276382    8.371536
O:   -23.809097   -0.622100    6.600525
O:   -22.400162    0.821838    7.381882
O:   -21.933014   -1.789413    8.379059
O:   -25.025909    1.236542    8.364014
T:  -18.638962    9.186081  -17.843933
T:  -16.900452   10.975754  -15.291580
O:   -17.230057   10.630020  -17.062561
O:   -15.821152   12.073990  -16.281204
O:   -15.354019    9.462769  -15.284027
O:   -18.446900   12.488693  -15.299057
T:  -19.392929    8.429123  -15.085571
T:  -17.654388   10.218842  -12.533234
O:   -17.984009    9.873108  -14.304214
O:   -16.575089   11.317047  -13.522903
O:   -16.107971    8.705841  -12.525711
O:   -19.200836   11.731781  -12.540787
T:  -20.146866    7.672226  -12.327286
T:  -18.408325    9.461900   -9.774902
O:   -18.737946    9.116180  -11.545944
O:   -17.329025   10.560165  -10.764542
O:   -16.861908    7.948898   -9.767380
O:   -19.954773   10.974854   -9.782410
T:  -20.900818    6.915329   -9.568909
T:  -19.162262    8.704987   -7.016602
O:   -19.491898    8.359253   -8.787537
O:   -18.082977    9.803268   -8.006210
O:   -17.615860    7.192032   -7.009018
O:   -20.708710   10.217926   -7.024094
T:  -21.654755    6.158356   -6.810577
T:  -19.916229    7.948059   -4.258194
O:   -20.245819    7.602341   -6.029251
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O:   -18.369797    6.435089   -4.250687
T:  -22.408691    5.401459   -4.052246
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T:  -23.162628    4.644547   -1.293991
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T:  -23.916580    3.887619    1.464447
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T:  -24.670532    3.130692    4.222748
O:   -21.385559    3.407394    6.782608
T:  -25.424469    2.373779    6.981079
O:   -22.139496    2.650482    9.540939
T:  -18.845428   13.625916  -16.682007
T:  -17.106918   15.415558  -14.129654
O:   -17.436523   15.069885  -15.900635
O:   -16.027603   16.513840  -15.119278
O:   -15.560486   13.902588  -14.122131
T:  -19.599380   12.869003  -13.923660
T:  -17.860855   14.658646  -11.371277
O:   -18.190460   14.312973  -13.142319
O:   -16.781540   15.756912  -12.360977
O:   -16.314423   13.145706  -11.363800
T:  -20.353317   12.112076  -11.165344
T:  -18.614792   13.901733   -8.612961
O:   -18.944412   13.556046  -10.383987
O:   -17.535477   15.000000   -9.602631
O:   -17.068390   12.388748   -8.605438
T:  -21.107269   11.355148   -8.407013
T:  -19.368744   13.144806   -5.854675
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O:   -18.289429   14.243073   -6.844284
O:   -17.822311   11.631836   -5.847183
T:  -21.861206   10.598236   -5.648651
T:  -12.256546    6.432266  -15.268997
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T:  -13.010483    5.675354  -12.510651
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T:  -13.764404    4.918396   -9.752319
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T:  -18.288055    0.376907    6.797638
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O:   -14.009460   12.385071  -14.114594
T:  -14.955460    8.325485  -13.901093
T:  -13.216919   10.115219  -11.348785
O:   -13.546555    9.769470  -13.119720
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O:   -11.670502    8.602219  -11.341248
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T:  -15.709396    7.568604  -11.142807
T:  -13.970886    9.358276   -8.590454
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T:  -16.463348    6.811707   -8.384415
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T:  -17.971222    5.297836   -2.867767
O:   -14.686279    5.574509   -0.307922
T:  -18.725143    4.540924   -0.109528
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T:  -19.479111    3.783981    2.648895
O:   -16.194153    4.060700    5.208740
T:  -20.233032    3.027069    5.407211
O:   -16.948090    3.303772    7.967087
T:  -20.987000    2.270157    8.165558
O:   -17.702057    2.546844   10.725449
T:  -14.407974   13.522293  -15.497513
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T:  -15.161926   12.765366  -12.739197
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T:  -15.915863   12.008453   -9.980865
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T:  -13.096634    1.030182    5.223785
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O:    26.552353   10.595581    5.997528
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