1038
structure
C     170.797000 -141.086000    7.891890
C     169.964000 -141.852000    8.706930
C     169.780000 -141.511000   10.053800
C     170.439000 -140.387000   10.572600
C     171.260000 -139.609000    9.752300
C     171.446000 -139.956000    8.406730
C     168.926000 -142.345000   10.917600
C     167.820000 -143.042000   10.357300
C     167.054000 -143.860000   11.191100
N     167.420000 -143.945000   12.477900
C     168.460000 -143.344000   13.074900
C     169.251000 -142.499000   12.292400
C     165.888000 -144.723000   10.807300
C     168.676000 -143.733000   14.508000
C     165.323000 -144.731000    9.530560
C     164.229000 -145.569000    9.285510
C     163.715000 -146.384000   10.304400
C     164.303000 -146.355000   11.572800
N     165.361000 -145.534000   11.786300
N     167.822000 -144.674000   15.036800
C     167.919000 -145.122000   16.313100
C     168.925000 -144.607000   17.135700
C     169.811000 -143.648000   16.626100
C     169.694000 -143.204000   15.303700
C     162.102000 -150.079000   18.976600
C     162.674000 -149.116000   18.135800
C     163.554000 -149.498000   17.110200
C     163.839000 -150.858000   16.936800
C     163.264000 -151.815000   17.768700
C     162.387000 -151.443000   18.799300
C     164.212000 -148.491000   16.245600
C     163.753000 -147.144000   16.224200
C     164.417000 -146.223000   15.404800
N     165.458000 -146.672000   14.689900
C     165.958000 -147.914000   14.661500
C     165.329000 -148.876000   15.452900
C     164.122000 -144.761000   15.232000
C     167.164000 -148.093000   13.786300
C     163.068000 -144.108000   15.873200
C     162.881000 -142.741000   15.634900
C     163.737000 -142.046000   14.769000
C     164.784000 -142.727000   14.141400
N     164.946000 -144.050000   14.387700
N     167.627000 -146.978000   13.125900
C     168.711000 -147.000000   12.310900
C     169.393000 -148.207000   12.126900
C     168.946000 -149.361000   12.785600
C     167.825000 -149.311000   13.623300
C     161.068000 -154.566000   21.477700
C     160.278000 -153.393000   21.359500
C     160.659000 -152.364000   20.459500
C     161.856000 -152.490000   19.713900
C     162.615000 -153.651000   19.862000
C     162.250000 -154.686000   20.720600
O     160.752000 -155.574000   22.402000
O     159.187000 -153.225000   22.225000
O     159.877000 -151.208000   20.377100
C     157.963000 -152.953000   21.555500
C     159.401000 -156.015000   22.345200
C     159.180000 -151.123000   19.140400
Ru    166.434000 -145.305000   13.584300
C     174.180000 -141.061000    9.148950
C     174.724000 -141.711000   10.257600
C     175.375000 -140.977000   11.258700
C     175.461000 -139.582000   11.141800
C     174.899000 -138.930000   10.041900
C     174.261000 -139.666000    9.033190
C     175.986000 -141.671000   12.406600
C     175.371000 -142.838000   12.938700
C     175.982000 -143.480000   14.020800
N     177.129000 -142.958000   14.479400
C     177.775000 -141.874000   14.027200
C     177.201000 -141.181000   12.958400
C     175.514000 -144.707000   14.747300
C     179.062000 -141.566000   14.734800
C     174.339000 -145.390000   14.426900
C     173.996000 -146.523000   15.173400
C     174.819000 -146.961000   16.220600
C     175.990000 -146.256000   16.518200
N     176.300000 -145.160000   15.782500
N     179.430000 -142.409000   15.758300
C     180.578000 -142.254000   16.464400
C     181.427000 -141.190000   16.146900
C     181.080000 -140.313000   15.109800
C     179.891000 -140.496000   14.393200
C     181.890000 -146.598000   22.929500
C     181.095000 -146.044000   21.919800
C     180.945000 -146.702000   20.690000
C     181.587000 -147.933000   20.499600
C     182.370000 -148.489000   21.511700
C     182.537000 -147.830000   22.741900
C     180.181000 -146.083000   19.584200
C     179.240000 -145.048000   19.848900
C     178.571000 -144.458000   18.769600
N     178.869000 -144.903000   17.540600
C     179.748000 -145.857000   17.206400
C     180.436000 -146.490000   18.244700
C     177.570000 -143.340000   18.806200
C     179.911000 -146.079000   15.731100
C     177.102000 -142.763000   19.988000
C     176.161000 -141.729000   19.904200
C     175.702000 -141.284000   18.656500
C     176.189000 -141.880000   17.490100
N     177.099000 -142.880000   17.596600
N     179.171000 -145.277000   14.892300
C     179.231000 -145.370000   13.540800
C     180.080000 -146.321000   12.966000
C     180.847000 -147.152000   13.793500
C     180.768000 -147.036000   15.186400
C     185.525000 -149.362000   25.461900
C     184.569000 -148.441000   25.954600
C     183.529000 -147.972000   25.110400
C     183.477000 -148.392000   23.756100
C     184.424000 -149.316000   23.309400
C     185.438000 -149.806000   24.129800
O     186.578000 -149.829000   26.263700
O     184.740000 -147.918000   27.244500
O     182.611000 -147.048000   25.616400
C     183.603000 -148.081000   28.081500
C     186.164000 -150.338000   27.525500
C     181.325000 -147.626000   25.799300
Ru    177.997000 -143.933000   16.009300
C     176.539000 -136.794000    7.498900
C     177.897000 -136.661000    7.796420
C     178.706000 -137.798000    7.932180
C     178.144000 -139.068000    7.751570
C     176.792000 -139.201000    7.432470
C     175.977000 -138.065000    7.310900
C     180.135000 -137.660000    8.244930
C     180.736000 -138.522000    9.202640
C     182.100000 -138.369000    9.472800
N     182.761000 -137.423000    8.791340
C     182.272000 -136.587000    7.863640
C     180.909000 -136.680000    7.568350
C     182.941000 -139.153000   10.438200
C     183.285000 -135.674000    7.239410
C     182.433000 -140.161000   11.259600
C     183.307000 -140.822000   12.130300
C     184.665000 -140.476000   12.173400
C     185.145000 -139.463000   11.338700
N     184.279000 -138.836000   10.504100
N     184.585000 -135.791000    7.675260
C     185.599000 -135.038000    7.180590
C     185.319000 -134.097000    6.185040
C     184.004000 -133.954000    5.719170
C     182.975000 -134.745000    6.243990
C     192.726000 -135.219000   10.586900
C     191.346000 -135.445000   10.541400
C     190.833000 -136.607000    9.943380
C     191.728000 -137.544000    9.411130
C     193.103000 -137.321000    9.465480
C     193.624000 -136.156000   10.051400
C     189.373000 -136.817000    9.814520
C     188.463000 -136.049000   10.594100
C     187.090000 -136.247000   10.410600
N     186.713000 -137.153000    9.496890
C     187.500000 -137.901000    8.712650
C     188.881000 -137.753000    8.860780
C     185.959000 -135.527000   11.085900
C     186.772000 -138.768000    7.727820
C     186.142000 -134.574000   12.089200
C     185.013000 -133.968000   12.654100
C     183.727000 -134.314000   12.217300
C     183.575000 -135.270000   11.209300
N     184.682000 -135.844000   10.678500
N     185.398000 -138.683000    7.715140
C     184.622000 -139.407000    6.871700
C     185.237000 -140.283000    5.972230
C     186.634000 -140.392000    5.959520
C     187.414000 -139.632000    6.839470
C     197.839000 -135.361000    9.549020
C     197.146000 -134.708000   10.598000
C     195.775000 -134.987000   10.830400
C     195.089000 -135.895000    9.985120
C     195.805000 -136.530000    8.969420
C     197.156000 -136.284000    8.731420
O     199.191000 -135.090000    9.292630
O     197.814000 -133.712000   11.324800
O     195.107000 -134.308000   11.854800
C     197.787000 -133.915000   12.731500
C     200.032000 -135.244000   10.428800
C     194.770000 -135.171000   12.933900
Ru    184.736000 -137.290000    9.147970
C     176.002000 -137.379000    4.345030
C     176.832000 -136.620000    3.518480
C     176.530000 -135.278000    3.248600
C     175.385000 -134.706000    3.821770
C     174.563000 -135.459000    4.662120
C     174.865000 -136.802000    4.928770
C     177.401000 -134.481000    2.365130
C     178.789000 -134.778000    2.285720
C     179.589000 -134.010000    1.434550
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C     177.688000 -132.709000    0.736337
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C     181.063000 -134.146000    1.186400
C     177.314000 -131.608000   -0.212063
C     181.873000 -135.070000    1.850050
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C     183.780000 -134.222000    0.601760
C     182.944000 -133.308000   -0.046815
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N     178.324000 -131.074000   -0.979208
C     178.118000 -130.083000   -1.882890
C     176.826000 -129.576000   -2.046750
C     175.775000 -130.100000   -1.280470
C     176.013000 -131.124000   -0.355475
C     184.987000 -126.929000   -5.181200
C     184.223000 -127.633000   -4.242770
C     183.602000 -128.843000   -4.592410
C     183.760000 -129.329000   -5.896640
C     184.520000 -128.626000   -6.827910
C     185.148000 -127.415000   -6.488860
C     182.792000 -129.605000   -3.612510
C     182.638000 -129.130000   -2.278920
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C     181.400000 -131.521000   -3.081970
C     182.161000 -130.815000   -4.014800
C     181.548000 -129.566000    0.047694
C     180.636000 -132.794000   -3.297600
C     182.036000 -128.442000    0.715177
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C     180.843000 -129.165000    2.707570
C     180.368000 -130.282000    2.012680
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C     179.867000 -134.664000   -4.600130
C     180.614000 -133.484000   -4.511420
C     187.447000 -125.498000   -9.612810
C     187.494000 -124.953000   -8.300840
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C     185.986000 -127.242000   -8.806480
C     186.719000 -126.678000   -9.848080
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O     186.724000 -124.976000   -5.976770
C     189.576000 -123.844000   -8.430450
C     187.576000 -123.565000  -10.939100
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Ru    180.153000 -132.026000   -0.554751
C     172.559000 -137.623000    3.008930
C     171.960000 -137.189000    1.823810
C     170.842000 -136.342000    1.862230
C     170.358000 -135.906000    3.104290
C     170.968000 -136.326000    4.288560
C     172.062000 -137.202000    4.250300
C     170.154000 -135.955000    0.615076
C     170.892000 -135.821000   -0.593561
C     170.206000 -135.466000   -1.760090
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C     168.113000 -135.405000   -0.575033
C     168.748000 -135.740000    0.624640
C     170.778000 -135.229000   -3.127050
C     166.652000 -135.141000   -0.799647
C     172.134000 -135.369000   -3.429030
C     172.559000 -135.122000   -4.739990
C     171.638000 -134.742000   -5.726540
C     170.287000 -134.609000   -5.393900
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N     166.268000 -134.791000   -2.074450
C     164.977000 -134.548000   -2.414230
C     163.989000 -134.652000   -1.430640
C     164.349000 -135.004000   -0.122409
C     165.688000 -135.253000    0.202960
C     164.254000 -131.269000  -10.074200
C     164.846000 -131.651000   -8.865470
C     165.220000 -132.986000   -8.643890
C     164.987000 -133.927000   -9.656360
C     164.404000 -133.543000  -10.864500
C     164.035000 -132.207000  -11.096400
C     165.848000 -133.400000   -7.366000
C     166.330000 -132.418000   -6.454530
C     166.930000 -132.843000   -5.263940
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C     165.983000 -134.784000   -7.057680
C     167.536000 -131.993000   -4.185790
C     166.841000 -136.536000   -5.333040
C     167.548000 -130.598000   -4.220550
C     168.142000 -129.904000   -3.159230
C     168.713000 -130.601000   -2.085500
C     168.688000 -131.999000   -2.079350
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N     167.486000 -136.644000   -4.121350
C     167.772000 -137.836000   -3.541960
C     167.400000 -139.013000   -4.198740
C     166.744000 -138.937000   -5.435320
C     166.459000 -137.694000   -6.013020
C     162.045000 -131.287000  -14.825900
C     162.647000 -130.233000  -14.096900
C     163.347000 -130.508000  -12.895000
C     163.390000 -131.833000  -12.389100
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C     162.119000 -132.604000  -14.334000
O     161.294000 -131.041000  -15.985900
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C     163.633000 -128.178000  -14.728400
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Ru    167.938000 -134.734000   -3.357210
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C     169.982000 -139.363000    4.839670
C     170.348000 -138.722000    6.031860
C     166.234000 -139.504000    5.180330
C     165.698000 -139.270000    3.885680
C     164.360000 -139.602000    3.651900
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C     164.112000 -140.412000    5.905040
C     165.436000 -140.082000    6.202490
C     163.590000 -139.463000    2.371310
C     163.116000 -141.096000    6.795140
C     164.119000 -138.892000    1.212540
C     163.307000 -138.805000    0.075510
C     161.990000 -139.284000    0.104670
C     161.488000 -139.852000    1.279790
N     162.293000 -139.923000    2.368840
N     161.882000 -141.376000    6.254210
C     160.903000 -142.012000    6.943230
C     161.148000 -142.399000    8.264500
C     162.395000 -142.128000    8.844520
C     163.392000 -141.474000    8.110700
C     153.618000 -142.321000    3.095280
C     154.912000 -141.847000    3.343550
C     156.031000 -142.643000    3.052170
C     155.828000 -143.915000    2.502650
C     154.540000 -144.383000    2.255610
C     153.412000 -143.599000    2.548820
C     157.407000 -142.167000    3.326670
C     157.632000 -140.854000    3.830490
C     158.948000 -140.450000    4.082980
N     159.924000 -141.333000    3.832050
C     159.799000 -142.583000    3.367280
C     158.508000 -143.039000    3.095480
C     159.420000 -139.130000    4.622080
C     161.088000 -143.335000    3.215450
C     158.561000 -138.077000    4.940230
C     159.111000 -136.889000    5.437580
C     160.497000 -136.764000    5.611490
C     161.332000 -137.837000    5.284940
N     160.776000 -138.977000    4.804360
N     162.242000 -142.676000    3.571770
C     163.472000 -143.241000    3.484190
C     163.581000 -144.552000    3.011420
C     162.424000 -145.251000    2.640630
C     161.165000 -144.646000    2.740600
C     149.559000 -145.442000    1.858910
C     149.599000 -144.086000    2.288970
C     150.845000 -143.450000    2.522280
C     152.049000 -144.156000    2.293280
C     151.971000 -145.456000    1.788770
C     150.762000 -146.107000    1.555140
O     148.343000 -146.115000    1.682410
O     148.422000 -143.372000    2.550320
O     150.891000 -142.142000    3.024160
C     147.545000 -143.312000    1.431630
C     147.554000 -146.158000    2.865360
C     150.220000 -141.196000    2.201270
Ru    161.797000 -140.733000    4.249700
C     182.785000 -157.924000   -4.955620
C     183.828000 -158.085000   -4.042410
C     184.269000 -159.368000   -3.689240
C     183.663000 -160.488000   -4.276110
C     182.632000 -160.327000   -5.204710
C     182.181000 -159.044000   -5.545050
C     185.341000 -159.536000   -2.694650
C     186.401000 -158.590000   -2.633520
C     187.400000 -158.769000   -1.672120
N     187.284000 -159.821000   -0.850100
C     186.313000 -160.745000   -0.832715
C     185.296000 -160.628000   -1.785160
C     188.606000 -157.910000   -1.431090
C     186.447000 -161.781000    0.244840
C     188.914000 -156.782000   -2.193960
C     190.071000 -156.057000   -1.884730
C     190.901000 -156.460000   -0.829487
C     190.568000 -157.594000   -0.083390
N     189.442000 -158.281000   -0.402353
N     187.535000 -161.676000    1.081600
C     187.763000 -162.536000    2.105020
C     186.859000 -163.580000    2.324260
C     185.741000 -163.714000    1.489410
C     185.526000 -162.811000    0.441140
C     195.029000 -161.658000    5.851720
C     194.065000 -161.551000    4.842420
C     193.123000 -160.510000    4.865540
C     193.174000 -159.576000    5.908040
C     194.141000 -159.678000    6.905350
C     195.087000 -160.718000    6.894150
C     192.072000 -160.404000    3.828760
C     192.221000 -161.069000    2.578840
C     191.205000 -160.936000    1.624440
N     190.140000 -160.194000    1.956560
C     189.922000 -159.541000    3.105680
C     190.908000 -159.629000    4.090220
C     191.157000 -161.519000    0.241307
C     188.625000 -158.790000    3.170970
C     192.169000 -162.318000   -0.293945
C     192.021000 -162.804000   -1.598760
C     190.879000 -162.492000   -2.349720
C     189.883000 -161.689000   -1.787210
N     190.048000 -161.231000   -0.521470
N     187.815000 -158.842000    2.059640
C     186.614000 -158.216000    1.991840
C     186.172000 -157.482000    3.096430
C     186.974000 -157.409000    4.243820
C     188.210000 -158.065000    4.289310
C     197.638000 -161.112000   10.362400
C     197.988000 -161.811000    9.180750
C     197.211000 -161.657000    8.003590
C     196.052000 -160.841000    8.026720
C     195.745000 -160.157000    9.204090
C     196.507000 -160.271000   10.365800
O     198.384000 -161.259000   11.540800
O     199.045000 -162.731000    9.234870
O     197.572000 -162.365000    6.853830
C     200.049000 -162.508000    8.253270
C     199.773000 -161.005000   11.374100
C     198.119000 -161.510000    5.857220
Ru    188.711000 -160.009000    0.553489
C     179.839000 -159.590000   -3.684790
C     179.678000 -160.313000   -2.502650
C     179.253000 -161.648000   -2.541960
C     178.996000 -162.252000   -3.780840
C     179.176000 -161.534000   -4.965630
C     179.596000 -160.197000   -4.924850
C     179.066000 -162.400000   -1.291430
C     179.961000 -162.198000   -0.206024
C     179.750000 -162.914000    0.975054
N     178.696000 -163.744000    1.013170
C     177.798000 -163.972000    0.045299
C     177.971000 -163.297000   -1.166640
C     180.550000 -162.852000    2.242310
C     176.686000 -164.906000    0.423860
C     181.704000 -162.080000    2.386160
C     182.381000 -162.105000    3.611370
C     181.905000 -162.892000    4.669840
C     180.746000 -163.655000    4.496010
N     180.108000 -163.614000    3.300000
N     176.702000 -165.410000    1.704360
C     175.744000 -166.245000    2.179240
C     174.694000 -166.618000    1.335000
C     174.649000 -166.121000    0.024876
C     175.648000 -165.257000   -0.440670
C     177.334000 -169.435000    9.614920
C     177.646000 -168.798000    8.408440
C     177.180000 -167.500000    8.145880
C     176.402000 -166.854000    9.116330
C     176.094000 -167.490000   10.317300
C     176.554000 -168.790000   10.588000
C     177.485000 -166.819000    6.865170
C     178.298000 -167.457000    5.885720
C     178.553000 -166.786000    4.684130
N     178.009000 -165.571000    4.529000
C     177.231000 -164.905000    5.393110
C     176.946000 -165.527000    6.610010
C     179.361000 -167.266000    3.514010
C     176.756000 -163.565000    4.913990
C     180.016000 -168.498000    3.484460
C     180.746000 -168.844000    2.340440
C     180.814000 -167.967000    1.248760
C     180.147000 -166.740000    1.307010
N     179.447000 -166.427000    2.425540
N     177.154000 -163.173000    3.656740
C     176.794000 -161.988000    3.105230
C     175.982000 -161.120000    3.840810
C     175.559000 -161.490000    5.124710
C     175.943000 -162.720000    5.671920
C     175.304000 -170.576000   14.320900
C     176.379000 -171.170000   13.605400
C     176.805000 -170.612000   12.375200
C     176.177000 -169.448000   11.873800
C     175.168000 -168.853000   12.634700
C     174.729000 -169.380000   13.848600
O     174.782000 -171.175000   15.473900
O     176.991000 -172.351000   14.050600
O     177.822000 -171.227000   11.633700
C     177.433000 -172.291000   15.401700
C     174.218000 -172.454000   15.216300
C     179.053000 -171.318000   12.338900
Ru    178.356000 -164.659000    2.771060
C     176.678000 -160.653000   -7.563000
C     175.414000 -161.143000   -7.225650
C     174.812000 -160.771000   -6.015540
C     175.482000 -159.895000   -5.152380
C     176.735000 -159.389000   -5.499380
C     177.345000 -159.768000   -6.703880
C     173.484000 -161.284000   -5.657140
C     173.245000 -161.763000   -4.340230
C     171.970000 -162.245000   -4.028660
N     171.043000 -162.203000   -4.994320
C     171.186000 -161.759000   -6.252080
C     172.446000 -161.286000   -6.627000
C     171.499000 -162.822000   -2.725480
C     169.944000 -161.827000   -7.090330
C     172.319000 -162.964000   -1.604700
C     171.776000 -163.524000   -0.442362
C     170.435000 -163.934000   -0.409598
C     169.639000 -163.780000   -1.548330
N     170.187000 -163.234000   -2.662360
N     168.814000 -162.338000   -6.494120
C     167.624000 -162.440000   -7.136150
C     167.533000 -162.010000   -8.463510
C     168.667000 -161.484000   -9.099050
C     169.884000 -161.388000   -8.414370
C     161.678000 -166.466000   -3.817220
C     163.012000 -166.075000   -3.972950
C     163.497000 -164.927000   -3.328470
C     162.626000 -164.189000   -2.514870
C     161.299000 -164.587000   -2.352600
C     160.805000 -165.732000   -2.999930
C     164.887000 -164.466000   -3.544790
C     165.863000 -165.357000   -4.072350
C     167.156000 -164.874000   -4.302490
N     167.394000 -163.586000   -4.016310
C     166.532000 -162.681000   -3.534780
C     165.228000 -163.111000   -3.274650
C     168.326000 -165.616000   -4.881380
C     167.086000 -161.294000   -3.390700
C     168.289000 -166.970000   -5.216870
C     169.442000 -167.562000   -5.746650
C     170.607000 -166.807000   -5.935570
C     170.613000 -165.452000   -5.592220
N     169.485000 -164.901000   -5.080160
N     168.390000 -161.096000   -3.785370
C     169.008000 -159.892000   -3.712130
C     168.296000 -158.796000   -3.214840
C     166.965000 -158.964000   -2.806430
C     166.349000 -160.218000   -2.892580
C     156.546000 -166.428000   -2.983490
C     157.410000 -167.512000   -3.272240
C     158.814000 -167.337000   -3.228160
C     159.356000 -166.069000   -2.899160
C     158.479000 -165.046000   -2.530700
C     157.094000 -165.208000   -2.545720
O     155.151000 -166.581000   -2.988260
O     156.856000 -168.753000   -3.613350
O     159.638000 -168.422000   -3.546550
C     157.210000 -169.790000   -2.708630
C     154.636000 -167.146000   -4.187670
C     160.358000 -168.896000   -2.415300
Ru    169.220000 -162.894000   -4.502180
C     176.546000 -157.645000   -8.741440
C     175.479000 -157.446000   -9.619100
C     175.576000 -157.857000  -10.955700
C     176.751000 -158.477000  -11.400800
C     177.811000 -158.694000  -10.518500
C     177.718000 -158.276000   -9.183360
C     174.462000 -157.621000  -11.887100
C     173.121000 -157.745000  -11.431200
C     172.084000 -157.502000  -12.336600
N     172.425000 -157.153000  -13.585600
C     173.659000 -156.987000  -14.082700
C     174.736000 -157.236000  -13.227400
C     170.607000 -157.542000  -12.073000
C     173.708000 -156.491000  -15.498700
C     170.053000 -157.928000  -10.851300
C     168.659000 -157.939000  -10.719900
C     167.841000 -157.568000  -11.795900
C     168.425000 -157.185000  -13.007000
N     169.777000 -157.184000  -13.110600
N     172.504000 -156.242000  -16.116300
C     172.409000 -155.776000  -17.386200
C     173.582000 -155.540000  -18.108600
C     174.825000 -155.783000  -17.507600
C     174.897000 -156.261000  -16.193400
C     164.707000 -155.410000  -20.378100
C     165.734000 -155.848000  -19.527600
C     166.294000 -154.976000  -18.578800
C     165.804000 -153.668000  -18.496400
C     164.786000 -153.236000  -19.339100
C     164.220000 -154.095000  -20.296000
C     167.391000 -155.401000  -17.677600
C     167.856000 -156.747000  -17.673200
C     168.897000 -157.092000  -16.800200
N     169.394000 -156.123000  -16.018400
C     169.020000 -154.839000  -15.967400
C     167.986000 -154.440000  -16.812300
C     169.551000 -158.433000  -16.625700
C     169.787000 -153.990000  -14.997200
C     169.177000 -159.571000  -17.342400
C     169.857000 -160.771000  -17.099800
C     170.892000 -160.824000  -16.155700
C     171.245000 -159.667000  -15.453500
N     170.571000 -158.518000  -15.704600
N     170.783000 -154.609000  -14.278300
C     171.551000 -153.957000  -13.370300
C     171.326000 -152.595000  -13.149300
C     170.318000 -151.936000  -13.866600
C     169.539000 -152.631000  -14.798800
C     161.174000 -152.334000  -22.813900
C     161.408000 -153.735000  -22.911400
C     162.400000 -154.350000  -22.101300
C     163.143000 -153.566000  -21.189000
C     162.840000 -152.210000  -21.078800
C     161.869000 -151.579000  -21.850400
O     160.286000 -151.685000  -23.680000
O     160.732000 -154.520000  -23.856900
O     162.689000 -155.716000  -22.230000
C     159.316000 -154.395000  -23.794000
C     160.694000 -151.764000  -25.039400
C     161.552000 -156.560000  -22.099900
Ru    170.908000 -156.644000  -14.803100
C     179.514000 -155.909000   -9.923350
C     179.693000 -155.085000  -11.035000
C     180.663000 -155.396000  -11.998300
C     181.439000 -156.554000  -11.842900
C     181.247000 -157.389000  -10.739600
C     180.290000 -157.066000   -9.766730
C     180.895000 -154.486000  -13.132600
C     179.811000 -153.752000  -13.686800
C     180.072000 -152.861000  -14.732200
N     181.344000 -152.745000  -15.139600
C     182.421000 -153.379000  -14.655000
C     182.217000 -154.296000  -13.620600
C     179.099000 -151.963000  -15.437800
C     183.728000 -152.957000  -15.259800
C     177.727000 -151.961000  -15.181200
C     176.910000 -151.081000  -15.901100
C     177.464000 -150.219000  -16.858200
C     178.842000 -150.242000  -17.092000
N     179.612000 -151.106000  -16.384700
N     183.685000 -151.968000  -16.215500
C     184.795000 -151.480000  -16.822300
C     186.043000 -152.005000  -16.470900
C     186.120000 -153.014000  -15.500900
C     184.960000 -153.497000  -14.885100
C     183.658000 -146.307000  -22.959900
C     183.298000 -147.301000  -22.042900
C     182.940000 -146.961000  -20.728400
C     182.939000 -145.611000  -20.355600
C     183.291000 -144.622000  -21.272600
C     183.654000 -144.953000  -22.587900
C     182.611000 -148.006000  -19.732400
C     182.344000 -149.340000  -20.149500
C     182.058000 -150.303000  -19.174200
N     182.061000 -149.904000  -17.894600
C     182.308000 -148.676000  -17.419200
C     182.591000 -147.674000  -18.348500
C     181.754000 -151.759000  -19.377800
C     182.266000 -148.556000  -15.924100
C     181.690000 -152.363000  -20.634200
C     181.394000 -153.730000  -20.707500
C     181.169000 -154.472000  -19.540100
C     181.241000 -153.840000  -18.295500
N     181.528000 -152.515000  -18.249700
N     181.990000 -149.701000  -15.212500
C     181.926000 -149.730000  -13.858200
C     182.148000 -148.548000  -13.145700
C     182.432000 -147.365000  -13.841500
C     182.493000 -147.361000  -15.240200
C     185.144000 -141.776000  -25.108800
C     184.638000 -142.951000  -25.721600
C     184.094000 -143.992000  -24.927100
C     184.104000 -143.878000  -23.515200
C     184.612000 -142.711000  -22.943600
C     185.126000 -141.660000  -23.703500
O     185.753000 -140.763000  -25.865600
O     184.793000 -143.109000  -27.106300
O     183.622000 -145.149000  -25.553800
C     183.577000 -143.385000  -27.788800
C     184.976000 -140.314000  -26.968300
C     182.205000 -145.246000  -25.492300
Ru    181.702000 -151.326000  -16.519700
C     181.047000 -158.869000   -6.491370
C     179.781000 -159.426000   -6.183240
C     178.685000 -159.228000   -7.060670
C     178.860000 -158.481000   -8.253750
C     180.125000 -157.914000   -8.556020
C     181.219000 -158.111000   -7.676540
C     183.686000 -158.300000   -8.079000
C     184.937000 -157.718000   -8.289540
C     185.056000 -156.328000   -8.419580
C     183.910000 -155.526000   -8.335360
C     182.662000 -156.107000   -8.103170
C     182.541000 -157.498000   -7.974130
C     186.377000 -155.711000   -8.595850
C     186.550000 -154.661000   -9.537100
C     187.817000 -154.083000   -9.663320
N     188.790000 -154.550000   -8.867300
C     188.701000 -155.518000   -7.944750
C     187.463000 -156.147000   -7.789830
C     188.233000 -152.969000  -10.579100
C     189.959000 -155.768000   -7.166090
C     187.375000 -152.373000  -11.505000
C     187.872000 -151.347000  -12.317400
C     189.206000 -150.930000  -12.200100
C     190.041000 -151.546000  -11.263400
N     189.537000 -152.538000  -10.488200
N     191.050000 -154.987000   -7.473680
C     192.239000 -155.097000   -6.831920
C     192.373000 -156.046000   -5.814270
C     191.280000 -156.857000   -5.477260
C     190.061000 -156.722000   -6.152100
C     198.409000 -150.773000  -10.039700
C     197.149000 -151.383000  -10.041100
C     196.093000 -150.839000   -9.294840
C     196.321000 -149.669000   -8.558880
C     197.576000 -149.062000   -8.561310
C     198.643000 -149.603000   -9.298580
C     194.764000 -151.494000   -9.257040
C     194.498000 -152.635000  -10.067800
C     193.236000 -153.236000   -9.987630
N     192.348000 -152.696000   -9.141080
C     192.519000 -151.635000   -8.342010
C     193.758000 -150.993000   -8.383360
C     192.742000 -154.445000  -10.727400
C     191.338000 -151.293000   -7.481810
C     193.510000 -155.146000  -11.658300
C     192.948000 -156.263000  -12.288100
C     191.640000 -156.667000  -11.986800
C     190.895000 -155.946000  -11.049500
N     191.460000 -154.867000  -10.453800
N     190.228000 -152.099000   -7.595480
C     189.096000 -151.902000   -6.874310
C     189.047000 -150.835000   -5.973190
C     190.161000 -149.995000   -5.834110
C     191.318000 -150.220000   -6.589780
C     202.508000 -147.715000   -8.848370
C     202.345000 -148.704000   -9.856470
C     201.089000 -149.335000  -10.036200
C     199.988000 -148.955000   -9.231130
C     200.161000 -147.915000   -8.314020
C     201.387000 -147.283000   -8.117410
O     203.752000 -147.121000   -8.598470
O     203.425000 -149.124000  -10.645500
O     200.940000 -150.363000  -10.977200
C     204.053000 -148.058000  -11.348500
C     204.756000 -148.064000   -8.243490
C     201.266000 -149.967000  -12.303200
Ru    190.569000 -153.624000   -9.006530
C     164.493000 -155.747000   20.494500
C     165.309000 -156.867000   20.354800
C     164.777000 -158.159000   20.461400
C     163.409000 -158.305000   20.748700
C     162.588000 -157.178000   20.891200
C     163.121000 -155.887000   20.751000
C     165.628000 -159.334000   20.156900
C     165.093000 -160.644000   20.164400
C     165.907000 -161.702000   19.741400
N     167.157000 -161.462000   19.328000
C     167.707000 -160.243000   19.318500
C     166.960000 -159.137000   19.726800
C     165.546000 -163.089000   19.597400
C     169.031000 -160.241000   18.760300
C     164.319000 -163.639000   19.973900
C     164.113000 -165.007000   19.771700
C     165.123000 -165.791000   19.202600
C     166.334000 -165.194000   18.839800
N     166.521000 -163.862000   19.044900
N     169.448000 -161.461000   18.327500
C     170.676000 -161.625000   17.765700
C     171.533000 -160.528000   17.627300
C     171.112000 -159.268000   18.068000
C     169.848000 -159.115000   18.641100
C     173.598000 -168.624000   15.971000
C     172.640000 -167.843000   16.627100
C     171.714000 -167.083000   15.892800
C     171.755000 -167.139000   14.492300
C     172.712000 -167.914000   13.839600
C     173.650000 -168.660000   14.568700
C     170.764000 -166.166000   16.567700
C     170.830000 -165.954000   17.965100
C     169.981000 -164.998000   18.537700
N     169.137000 -164.303000   17.765600
C     169.032000 -164.482000   16.444600
C     169.846000 -165.415000   15.798700
C     169.932000 -164.574000   19.913600
C     168.095000 -163.574000   15.840800
C     170.685000 -165.132000   20.949000
C     170.534000 -164.609000   22.236200
C     169.648000 -163.551000   22.464000
C     168.917000 -163.025000   21.394100
N     169.072000 -163.545000   20.147000
N     167.530000 -162.703000   16.717200
C     166.622000 -161.778000   16.302200
C     166.257000 -161.714000   14.953500
C     166.835000 -162.605000   14.043100
C     167.766000 -163.549000   14.483800
Zn    168.142000 -162.895000   18.562600
C     187.784000 -150.614000   23.738700
C     188.688000 -151.434000   23.053300
C     188.224000 -152.413000   22.158200
C     186.841000 -152.566000   21.980900
C     185.942000 -151.744000   22.656700
C     186.403000 -150.756000   23.536300
C     189.164000 -153.207000   21.332500
C     188.673000 -154.266000   20.536000
C     189.552000 -154.921000   19.673400
N     190.829000 -154.534000   19.598400
C     191.344000 -153.545000   20.339200
C     190.527000 -152.842000   21.233400
C     189.236000 -155.959000   18.730700
C     192.727000 -153.292000   20.021900
C     187.987000 -156.571000   18.601600
C     187.832000 -157.566000   17.634200
C     188.911000 -157.928000   16.821600
C     190.142000 -157.284000   16.988000
N     190.279000 -156.317000   17.936200
N     193.219000 -154.077000   19.025100
C     194.510000 -153.965000   18.610600
C     195.355000 -153.028000   19.213100
C     194.859000 -152.213000   20.236800
C     193.531000 -152.340000   20.651300
C     196.233000 -159.983000   12.860800
C     195.709000 -159.279000   13.953000
C     195.011000 -158.076000   13.756800
C     194.867000 -157.585000   12.451500
C     195.385000 -158.286000   11.366400
C     196.069000 -159.496000   11.554000
C     194.364000 -157.364000   14.884200
C     194.372000 -157.905000   16.192300
C     193.664000 -157.232000   17.197700
N     192.996000 -156.110000   16.909600
C     192.968000 -155.562000   15.689800
C     193.647000 -156.172000   14.635600
C     193.491000 -157.628000   18.572600
C     192.133000 -154.394000   15.629400
C     194.088000 -158.741000   19.166700
C     193.831000 -158.992000   20.517000
C     192.991000 -158.139000   21.241500
C     192.414000 -157.038000   20.601400
N     192.674000 -156.806000   19.286600
N     191.523000 -154.091000   16.805600
C     190.694000 -153.018000   16.912100
C     190.458000 -152.205000   15.798600
C     191.079000 -152.510000   14.582500
C     191.927000 -153.616000   14.488200
Zn    191.927000 -155.323000   18.266100
C     198.827000 -136.447000    6.841850
C     199.345000 -137.128000    5.732030
C     198.845000 -138.390000    5.372930
C     197.831000 -138.961000    6.154930
C     197.315000 -138.284000    7.256200
C     197.801000 -137.018000    7.612470
C     199.319000 -139.094000    4.157870
C     198.760000 -140.345000    3.814190
C     199.166000 -140.962000    2.630920
N     200.065000 -140.367000    1.840410
C     200.630000 -139.188000    2.125130
C     200.274000 -138.503000    3.295530
C     198.690000 -142.203000    2.085550
C     201.538000 -138.758000    1.091740
C     197.756000 -143.041000    2.698580
C     197.387000 -144.217000    2.041810
C     197.949000 -144.531000    0.799665
C     198.879000 -143.658000    0.226489
N     199.230000 -142.516000    0.878430
N     201.626000 -139.617000    0.039007
C     202.439000 -139.355000   -1.018860
C     203.205000 -138.185000   -1.035280
C     203.122000 -137.295000    0.040780
C     202.281000 -137.577000    1.120200
C     202.502000 -146.210000   -6.139120
C     202.475000 -145.302000   -5.074660
C     201.407000 -144.400000   -4.933360
C     200.381000 -144.413000   -5.889270
C     200.404000 -145.322000   -6.945100
C     201.460000 -146.234000   -7.077670
C     201.299000 -143.522000   -3.745520
C     202.124000 -143.732000   -2.616320
C     201.896000 -142.963000   -1.468550
N     200.910000 -142.059000   -1.452650
C     200.118000 -141.816000   -2.502240
C     200.278000 -142.545000   -3.682600
C     202.546000 -143.081000   -0.188853
C     199.100000 -140.843000   -2.208520
C     203.620000 -143.929000    0.088332
C     204.142000 -143.939000    1.384430
C     203.587000 -143.114000    2.369360
C     202.509000 -142.285000    2.043870
N     202.013000 -142.285000    0.777304
N     199.121000 -140.393000   -0.925841
C     198.224000 -139.467000   -0.489704
C     197.260000 -138.963000   -1.368330
C     197.229000 -139.421000   -2.689890
C     198.155000 -140.372000   -3.122550
Zn    200.501000 -141.202000    0.191903
C     187.832000 -127.463000  -11.962500
C     187.819000 -128.247000  -13.122800
C     186.657000 -128.939000  -13.502500
C     185.504000 -128.805000  -12.715700
C     185.518000 -128.029000  -11.559000
C     186.684000 -127.359000  -11.162600
C     186.661000 -129.882000  -14.645800
C     185.475000 -130.571000  -14.987900
C     185.527000 -131.546000  -15.984000
N     186.687000 -131.826000  -16.588200
C     187.832000 -131.192000  -16.309700
C     187.863000 -130.199000  -15.322200
C     184.462000 -132.410000  -16.413900
C     188.941000 -131.722000  -17.061200
C     183.141000 -132.335000  -15.966300
C     182.215000 -133.250000  -16.472800
C     182.620000 -134.213000  -17.403700
C     183.955000 -134.248000  -17.818600
N     184.845000 -133.349000  -17.318200
N     188.614000 -132.765000  -17.871500
C     189.551000 -133.379000  -18.643300
C     190.877000 -132.936000  -18.613500
C     191.225000 -131.864000  -17.784200
C     190.252000 -131.245000  -16.995200
C     186.060000 -140.579000  -21.656400
C     186.398000 -139.452000  -20.909000
C     186.285000 -138.167000  -21.460100
C     185.848000 -138.039000  -22.788900
C     185.510000 -139.172000  -23.539400
C     185.604000 -140.455000  -22.977800
C     186.532000 -136.974000  -20.615500
C     186.860000 -137.136000  -19.250000
C     186.977000 -136.000000  -18.447000
N     186.770000 -134.786000  -18.969200
C     186.472000 -134.581000  -20.257200
C     186.335000 -135.670000  -21.127700
C     187.213000 -135.954000  -17.030000
C     186.245000 -133.188000  -20.547200
C     187.480000 -137.065000  -16.226800
C     187.683000 -136.863000  -14.859400
C     187.613000 -135.572000  -14.324600
C     187.339000 -134.492000  -15.170300
N     187.147000 -134.704000  -16.500500
N     186.344000 -132.373000  -19.462000
C     186.154000 -131.030000  -19.569200
C     185.855000 -130.467000  -20.813500
C     185.750000 -131.295000  -21.936100
C     185.945000 -132.673000  -21.809700
Zn    186.740000 -133.295000  -17.791300
C     161.737000 -133.858000  -16.470700
C     161.358000 -135.020000  -17.150200
C     160.806000 -136.106000  -16.453600
C     160.621000 -135.997000  -15.066900
C     161.008000 -134.840000  -14.387000
C     161.576000 -133.762000  -15.080700
C     160.549000 -137.394000  -17.139900
C     159.811000 -138.414000  -16.496000
C     159.727000 -139.669000  -17.107000
N     160.360000 -139.894000  -18.264400
C     161.057000 -138.955000  -18.915100
C     161.179000 -137.672000  -18.373900
C     159.127000 -140.864000  -16.572800
C     161.728000 -139.478000  -20.075500
C     158.360000 -140.921000  -15.407500
C     157.839000 -142.157000  -15.015100
C     158.091000 -143.299000  -15.782000
C     158.869000 -143.192000  -16.939500
N     159.367000 -141.982000  -17.310700
N     161.563000 -140.816000  -20.251800
C     162.142000 -141.466000  -21.298200
C     162.919000 -140.753000  -22.216500
C     163.097000 -139.376000  -22.043500
C     162.499000 -138.724000  -20.962100
C     162.668000 -149.377000  -21.010900
C     162.464000 -148.050000  -20.652800
C     161.231000 -147.428000  -20.885300
C     160.211000 -148.160000  -21.515200
C     160.417000 -149.501000  -21.872700
C     161.648000 -150.127000  -21.614300
C     161.018000 -146.043000  -20.408300
C     161.931000 -145.489000  -19.483400
C     161.722000 -144.189000  -19.027900
N     160.676000 -143.485000  -19.469500
C     159.784000 -143.962000  -20.345900
C     159.919000 -145.266000  -20.846900
C     162.533000 -143.452000  -18.102000
C     158.782000 -142.982000  -20.684900
C     163.669000 -143.950000  -17.458700
C     164.350000 -143.114000  -16.570600
C     163.890000 -141.813000  -16.343200
C     162.748000 -141.361000  -17.012700
N     162.095000 -142.186000  -17.875400
N     158.948000 -141.780000  -20.065400
C     158.092000 -140.748000  -20.289400
C     157.018000 -140.912000  -21.169900
C     156.839000 -142.142000  -21.812800
C     157.727000 -143.194000  -21.573600
Zn    160.491000 -141.689000  -18.878200
C     151.892000 -147.887000    0.235256
C     152.058000 -149.216000   -0.143664
C     151.165000 -150.203000    0.296130
C     150.082000 -149.822000    1.106210
C     149.914000 -148.484000    1.485000
C     150.825000 -147.504000    1.059310
C     151.425000 -151.626000   -0.027387
C     150.611000 -152.656000    0.500846
C     150.965000 -153.986000    0.239432
N     152.055000 -154.260000   -0.487020
C     152.845000 -153.317000   -1.012160
C     152.560000 -151.969000   -0.796749
C     150.320000 -155.182000    0.720152
C     153.980000 -153.870000   -1.697650
C     149.151000 -155.208000    1.483090
C     148.640000 -156.448000    1.873000
C     149.296000 -157.626000    1.499860
C     150.466000 -157.549000    0.737936
N     150.952000 -156.334000    0.365235
N     154.039000 -155.228000   -1.660070
C     155.057000 -155.905000   -2.257010
C     156.066000 -155.203000   -2.923750
C     156.017000 -153.805000   -2.966050
C     154.966000 -153.124000   -2.347400
C     156.674000 -163.225000   -1.103750
C     155.972000 -162.060000   -0.795253
C     154.848000 -161.682000   -1.543820
C     154.427000 -162.510000   -2.597620
C     155.127000 -163.683000   -2.902940
C     156.261000 -164.046000   -2.161600
C     154.185000 -160.385000   -1.271610
C     154.551000 -159.635000   -0.130777
C     153.994000 -158.367000    0.047538
N     153.142000 -157.877000   -0.859903
C     152.759000 -158.552000   -1.950340
C     153.270000 -159.832000   -2.197880
C     154.294000 -157.420000    1.086340
C     151.888000 -157.773000   -2.793580
C     155.131000 -157.665000    2.176950
C     155.329000 -156.641000    3.106410
C     154.698000 -155.405000    2.931520
C     153.871000 -155.208000    1.821090
N     153.686000 -156.215000    0.925296
N     151.655000 -156.513000   -2.335690
C     150.851000 -155.652000   -3.016600
C     150.248000 -156.060000   -4.210550
C     150.484000 -157.352000   -4.693030
C     151.313000 -158.224000   -3.982750
Zn    152.579000 -156.074000   -0.677331
