nucleic.xyz

   767 
     1  O     12.630000   25.479000   39.440000   348     2     9
     2  C     13.937000   25.610000   38.876000   337     1     3    10    11
     3  C     14.887000   24.556000   39.393000   328     2     4     6    12
     4  O     15.100000   24.749000   40.813000   332     3     5
     5  C     14.742000   23.573000   41.522000   331     4     7    16    17
     6  C     14.387000   23.120000   39.235000   329     3     7     8    13
     7  C     13.819000   22.795000   40.604000   330     5     6    14    15
     8  O     15.483000   22.256000   38.923000   338     6    31
     9  H     11.964000   26.391000   39.073000   342     1
    10  H     13.847000   25.555000   37.684000   340     2
    11  H     14.320000   26.719000   39.098000   340     2
    12  H     15.954000   24.787000   38.908000   336     3
    13  H     13.785000   23.006000   38.210000   335     6
    14  H     13.713000   21.844000   41.301000   333     7
    15  H     12.674000   22.887000   40.274000   333     7
    16  H     15.848000   23.231000   41.807000   334     5
    17  N     14.136000   23.979000   42.789000   252     5    18    26
    18  C     14.571000   23.668000   44.053000   248    17    19    27
    19  N     13.823000   24.162000   45.006000   255    18    20
    20  C     12.827000   24.850000   44.330000   250    19    21    26
    21  C     11.720000   25.593000   44.773000   249    20    22    23
    22  N     11.417000   25.776000   46.062000   253    21    28    29
    23  N     10.922000   26.154000   43.837000   257    21    24
    24  C     11.225000   25.969000   42.547000   254    23    25    30
    25  N     12.236000   25.291000   42.006000   256    24    26
    26  C     13.008000   24.748000   42.962000   247    17    20    25
    27  H     15.664000   23.489000   44.485000   258    18
    28  H     12.028000   26.574000   46.696000   260    22
    29  H     10.394000   25.442000   46.564000   260    22
    30  H     10.436000   26.545000   41.871000   259    24
    31  P     15.226000   20.682000   38.734000   343     8    32    33    34
    32  O     16.366000   20.118000   37.964000   344    31
    33  O     13.841000   20.501000   38.232000   344    31
    34  O     15.303000   20.113000   40.220000   341    31    35
    35  C     16.564000   20.044000   40.908000   337    34    36    42    43
    36  C     16.468000   19.107000   42.089000   328    35    37    39    44
    37  O     15.772000   19.742000   43.187000   332    36    38
    38  C     14.687000   18.932000   43.612000   331    37    40    48    49
    39  C     15.724000   17.801000   41.812000   329    36    40    41    45
    40  C     14.356000   18.037000   42.428000   330    38    39    46    47
    41  O     16.404000   16.721000   42.454000   338    39    64
    42  H     17.381000   19.597000   40.156000   340    35
    43  H     17.086000   21.063000   41.251000   340    35
    44  H     17.563000   18.934000   42.535000   336    36
    45  H     15.943000   17.448000   40.693000   335    39
    46  H     13.519000   17.374000   42.946000   333    40
    47  H     13.741000   18.042000   41.408000   333    40
    48  H     15.209000   18.469000   44.578000   334    38
    49  N     13.611000   19.821000   44.041000   281    38    50    59
    50  C     12.734000   20.510000   43.240000   276    49    51    60
    51  N     11.901000   21.254000   43.916000   282    50    52
    52  C     12.245000   21.037000   45.242000   279    51    53    59
    53  C     11.694000   21.577000   46.434000   274    52    54    55
    54  O     10.765000   22.385000   46.558000   285    53
    55  N     12.343000   21.088000   47.565000   277    53    56    61
    56  C     13.385000   20.195000   47.550000   273    55    57    58
    57  N     13.880000   19.840000   48.746000   278    56    62    63
    58  N     13.907000   19.685000   46.447000   283    56    59
    59  C     13.293000   20.148000   45.338000   275    49    52    58
    60  H     12.123000   20.172000   42.277000   286    50
    61  H     12.034000   21.627000   48.579000   284    55
    62  H     13.601000   18.971000   49.506000   287    57
    63  H     14.797000   20.478000   49.156000   287    57
    64  P     15.864000   15.221000   42.273000   343    41    65    66    67
    65  O     17.025000   14.295000   42.340000   344    64
    66  O     14.972000   15.195000   41.084000   344    64
    67  O     14.974000   15.005000   43.572000   341    64    68
    68  C     15.560000   15.108000   44.879000   337    67    69    75    76
    69  C     14.517000   14.859000   45.942000   328    68    70    72    77
    70  O     13.696000   16.033000   46.161000   332    69    71
    71  C     12.347000   15.607000   46.198000   331    70    73    81    82
    72  C     13.548000   13.717000   45.633000   329    69    73    74    78
    73  C     12.277000   14.444000   45.236000   330    71    72    79    80
    74  O     13.288000   12.999000   46.834000   338    72    94
    75  H     16.337000   14.196000   44.900000   340    68
    76  H     16.263000   16.031000   45.163000   340    68
    77  H     15.122000   14.737000   46.965000   336    69
    78  H     13.922000   12.887000   44.864000   335    72
    79  H     12.390000   14.463000   44.045000   333    73
    80  H     11.213000   13.901000   45.256000   333    73
    81  H     12.304000   15.359000   47.361000   334    71
    82  N     11.482000   16.758000   45.904000   262    71    83    89
    83  C     11.098000   17.584000   46.962000   266    82    84    85
    84  O     11.548000   17.354000   48.096000   270    83
    85  N     10.253000   18.611000   46.727000   268    83    86
    86  C      9.802000   18.833000   45.491000   267    85    87    88
    87  N      8.947000   19.842000   45.313000   264    86    90    91
    88  C     10.202000   18.026000   44.386000   263    86    89    92
    89  C     11.038000   17.009000   44.636000   265    82    88    93
    90  H      8.547000   20.581000   46.157000   272    87
    91  H      8.161000   19.901000   44.421000   272    87
    92  H      9.521000   18.038000   43.410000   269    88
    93  H     10.939000   16.341000   43.660000   271    89
    94  P     13.014000   11.424000   46.779000   343    74    95    96    97
    95  O     14.232000   10.763000   46.245000   344    94
    96  O     11.710000   11.208000   46.113000   344    94
    97  O     12.864000   11.047000   48.316000   341    94    98
    98  C     13.816000   11.527000   49.282000   337    97    99   105   106
    99  C     13.106000   11.987000   50.532000   328    98   100   102   107
   100  O     12.426000   13.246000   50.296000   332    99   101
   101  C     11.051000   13.136000   50.637000   331   100   103   111   112
   102  C     12.042000   11.016000   51.035000   329    99   103   104   108
   103  C     10.737000   11.650000   50.588000   330   101   102   109   110
   104  O     12.112000   10.908000   52.455000   338   102   127
   105  H     14.467000   10.534000   49.439000   340    98
   106  H     14.678000   12.307000   49.007000   340    98
   107  H     13.920000   12.259000   51.363000   336    99
   108  H     12.311000    9.908000   50.684000   335   102
   109  H      9.745000   11.499000   51.222000   333   103
   110  H     10.508000   11.040000   49.590000   333   103
   111  H     11.118000   13.759000   51.653000   334   101
   112  N     10.288000   13.945000   49.690000   281   101   113   122
   113  C     10.397000   13.932000   48.320000   276   112   114   123
   114  N      9.590000   14.772000   47.733000   282   113   115
   115  C      8.902000   15.376000   48.777000   279   114   116   122
   116  C      7.893000   16.376000   48.755000   274   115   117   118
   117  O      7.390000   16.944000   47.780000   285   116
   118  N      7.466000   16.699000   50.038000   277   116   119   124
   119  C      7.948000   16.135000   51.194000   273   118   120   121
   120  N      7.403000   16.579000   52.334000   278   119   125   126
   121  N      8.891000   15.207000   51.230000   283   119   122
   122  C      9.320000   14.875000   49.992000   275   112   115   121
   123  H     10.700000   12.998000   47.669000   286   113
   124  H      6.826000   17.700000   50.082000   284   118
   125  H      6.624000   16.199000   53.146000   287   120
   126  H      7.866000   17.602000   52.732000   287   120
   127  P     11.265000    9.771000   53.202000   343   104   128   129   130
   128  O     11.788000    9.633000   54.588000   344   127
   129  O     11.213000    8.581000   52.315000   344   127
   130  O      9.810000   10.411000   53.273000   341   127   131
   131  C      9.586000   11.626000   54.005000   337   130   132   138   139
   132  C      8.119000   11.985000   53.982000   328   131   133   135   140
   133  O      7.780000   12.784000   52.821000   332   132   134
   134  C      6.585000   12.263000   52.269000   331   133   136   144   145
   135  C      7.175000   10.781000   53.962000   329   132   136   137   141
   136  C      6.651000   10.774000   52.536000   330   134   135   142   143
   137  O      6.090000   11.008000   54.854000   338   135   159
   138  H     10.246000   12.621000   53.958000   340   131
   139  H      9.837000   11.252000   55.117000   340   131
   140  H      7.928000   12.699000   54.920000   336   132
   141  H      7.620000    9.765000   54.404000   335   135
   142  H      5.668000   10.207000   52.178000   333   136
   143  H      7.419000    9.961000   52.113000   333   136
   144  H      5.746000   12.801000   52.923000   334   134
   145  N      6.498000   12.678000   50.855000   292   134   146   153
   146  C      5.745000   13.797000   50.569000   294   145   147   148
   147  O      5.193000   14.468000   51.427000   296   146
   148  N      5.666000   14.108000   49.237000   293   146   149   154
   149  C      6.256000   13.434000   48.185000   290   148   150   151
   150  O      6.085000   13.827000   47.035000   298   149
   151  C      7.048000   12.282000   48.559000   289   149   152   153
   152  C      7.738000   11.499000   47.487000   288   151   155   156   157
   153  C      7.128000   11.966000   49.859000   291   145   151   158
   154  H      4.888000   14.950000   48.918000   299   148
   155  H      7.935000   10.333000   47.683000   295   152
   156  H      8.688000   11.872000   46.862000   295   152
   157  H      6.874000   11.333000   46.672000   295   152
   158  H      7.250000   10.793000   49.960000   297   153
   159  P      5.237000    9.765000   55.398000   343   137   160   161   162
   160  O      5.824000    9.352000   56.698000   344   159
   161  O      5.098000    8.771000   54.303000   344   159
   162  O      3.808000   10.404000   55.671000   341   159   163
   163  C      3.681000   11.632000   56.401000   337   162   164   170   171
   164  C      2.372000   12.298000   56.056000   328   163   165   167   172
   165  O      2.476000   12.952000   54.766000   332   164   166
   166  C      1.450000   12.498000   53.898000   331   165   168   176   177
   167  C      1.216000   11.306000   55.946000   329   164   168   169   173
   168  C      1.008000   11.156000   54.450000   330   166   167   174   175
   169  O      0.041000   11.808000   56.580000   338   167   192
   170  H      3.707000   11.294000   57.554000   340   163
   171  H      4.575000   12.423000   56.380000   340   163
   172  H      2.192000   13.200000   56.815000   336   164
   173  H      1.380000   10.322000   56.602000   335   167
   174  H     -0.074000   10.848000   54.091000   333   168
   175  H      1.628000   10.170000   54.208000   333   168
   176  H      0.746000   13.460000   53.933000   334   166
   177  N      2.008000   12.399000   52.553000   281   166   178   187
   178  C      3.086000   11.641000   52.165000   276   177   179   188
   179  N      3.331000   11.711000   50.885000   282   178   180
   180  C      2.365000   12.577000   50.396000   279   179   181   187
   181  C      2.124000   13.030000   49.071000   274   180   182   183
   182  O      2.734000   12.739000   48.035000   285   181
   183  N      1.043000   13.905000   49.018000   277   181   184   189
   184  C      0.291000   14.296000   50.099000   273   183   185   186
   185  N     -0.705000   15.160000   49.843000   278   184   190   191
   186  N      0.500000   13.876000   51.338000   283   184   187
   187  C      1.545000   13.022000   51.412000   275   177   180   186
   188  H      3.275000   10.500000   52.415000   286   178
   189  H      1.060000   14.502000   47.990000   284   183
   190  H     -1.586000   15.476000   50.576000   287   185
   191  H     -0.532000   16.124000   49.164000   287   185
   192  P     -1.292000   10.912000   56.593000   343   169   193   194   195
   193  O     -1.938000   11.043000   57.924000   344   192
   194  O     -0.944000    9.562000   56.073000   344   192
   195  O     -2.205000   11.644000   55.520000   341   192   196
   196  C     -2.381000   13.065000   55.580000   337   195   197   203   204
   197  C     -3.371000   13.512000   54.533000   328   196   198   200   205
   198  O     -2.752000   13.517000   53.224000   332   197   199
   199  C     -3.527000   12.748000   52.321000   331   198   201   209   210
   200  C     -4.600000   12.614000   54.425000   329   197   201   202   206
   201  C     -4.320000   11.780000   53.185000   330   199   200   207   208
   202  O     -5.761000   13.425000   54.250000   338   200   225
   203  H     -2.843000   13.278000   56.665000   340   196
   204  H     -1.445000   13.806000   55.543000   340   196
   205  H     -3.635000   14.661000   54.725000   336   197
   206  H     -4.864000   12.050000   55.442000   335   200
   207  H     -5.174000   11.039000   52.810000   333   201
   208  H     -3.641000   10.879000   53.582000   333   201
   209  H     -4.068000   13.642000   51.750000   334   199
   210  N     -2.614000   12.128000   51.364000   281   199   211   220
   211  C     -1.592000   11.253000   51.642000   276   210   212   221
   212  N     -0.936000   10.878000   50.578000   282   211   213
   213  C     -1.561000   11.543000   49.532000   279   212   214   220
   214  C     -1.288000   11.534000   48.137000   274   213   215   216
   215  O     -0.405000   10.917000   47.528000   285   214
   216  N     -2.170000   12.347000   47.435000   277   214   217   222
   217  C     -3.184000   13.079000   48.001000   273   216   218   219
   218  N     -3.933000   13.798000   47.152000   278   217   223   224
   219  N     -3.447000   13.103000   49.299000   283   217   220
   220  C     -2.604000   12.317000   50.000000   275   210   213   219
   221  H     -1.578000   10.228000   52.242000   286   211
   222  H     -1.721000   12.605000   46.365000   284   216
   223  H     -3.920000   13.900000   45.967000   287   218
   224  H     -4.449000   14.789000   47.563000   287   218
   225  P     -7.216000   12.809000   54.530000   343   202   226   227   228
   226  O     -7.817000   13.525000   55.680000   344   225
   227  O     -7.079000   11.329000   54.572000   344   225
   228  O     -8.012000   13.201000   53.209000   341   225   229
   229  C     -7.333000   13.192000   51.948000   337   228   230   236   237
   230  C     -8.283000   13.522000   50.823000   328   229   231   233   238
   231  O     -7.552000   13.316000   49.595000   332   230   232
   232  C     -7.933000   12.089000   48.986000   331   231   234   242   243
   233  C     -9.485000   12.592000   50.727000   329   230   234   235   239
   234  C     -8.956000   11.434000   49.904000   330   232   233   240   241
   235  O    -10.560000   13.263000   50.065000   338   233   258
   236  H     -6.799000   14.262000   52.013000   340   229
   237  H     -6.645000   12.277000   51.662000   340   229
   238  H     -8.616000   14.669000   50.800000   336   230
   239  H    -10.052000   12.410000   51.761000   335   233
   240  H     -9.636000   10.571000   49.440000   333   234
   241  H     -8.640000   10.717000   50.812000   333   234
   242  H     -8.111000   12.573000   47.915000   334   232
   243  N     -6.725000   11.288000   48.835000   281   232   244   253
   244  C     -6.007000   10.683000   49.838000   276   243   245   254
   245  N     -4.963000   10.035000   49.403000   282   244   246
   246  C     -4.995000   10.221000   48.027000   279   245   247   253
   247  C     -4.117000    9.755000   47.019000   274   246   248   249
   248  O     -3.098000    9.063000   47.143000   285   247
   249  N     -4.523000   10.171000   45.755000   277   247   250   255
   250  C     -5.631000   10.940000   45.497000   273   249   251   252
   251  N     -5.863000   11.231000   44.211000   278   250   256   257
   252  N     -6.455000   11.386000   46.429000   283   250   253
   253  C     -6.079000   10.990000   47.663000   275   243   246   252
   254  H     -6.343000    9.912000   50.682000   286   244
   255  H     -3.672000   10.053000   44.933000   284   249
   256  H     -6.205000   12.333000   43.914000   287   251
   257  H     -5.647000   10.649000   43.196000   287   251
   258  P    -11.751000   12.405000   49.416000   343   235   259   260   261
   259  O    -12.764000   13.349000   48.874000   344   258
   260  O    -12.158000   11.384000   50.414000   344   258
   261  O    -11.057000   11.661000   48.193000   341   258   262
   262  C    -10.733000   12.374000   46.988000   337   261   263   269   270
   263  C    -10.690000   11.427000   45.813000   328   262   264   266   271
   264  O     -9.442000   10.691000   45.798000   332   263   265
   265  C     -9.699000    9.298000   45.690000   331   264   267   275   276
   266  C    -11.808000   10.383000   45.788000   329   263   267   268   272
   267  C    -11.110000    9.102000   46.215000   330   265   266   273   274
   268  O    -12.346000   10.271000   44.468000   338   266   290
   269  H    -11.719000   13.021000   46.773000   340   262
   270  H     -9.956000   13.272000   46.838000   340   262
   271  H    -10.665000   12.076000   44.812000   336   263
   272  H    -12.847000   10.675000   46.296000   335   266
   273  H    -11.460000    9.018000   47.357000   333   267
   274  H    -11.417000    7.980000   45.948000   333   267
   275  H     -9.382000    9.150000   44.555000   334   265
   276  N     -8.668000    8.591000   46.453000   252   265   277   285
   277  C     -8.651000    8.323000   47.800000   248   276   278   286
   278  N     -7.583000    7.674000   48.197000   255   277   279
   279  C     -6.847000    7.499000   47.035000   250   278   280   285
   280  C     -5.604000    6.887000   46.779000   249   279   281   282
   281  N     -4.854000    6.309000   47.723000   253   280   287   288
   282  N     -5.151000    6.885000   45.507000   257   280   283
   283  C     -5.902000    7.464000   44.560000   254   282   284   289
   284  N     -7.081000    8.073000   44.673000   256   283   285
   285  C     -7.504000    8.058000   45.950000   247   276   279   284
   286  H     -9.441000    7.999000   48.630000   258   277
   287  H     -5.162000    5.894000   48.793000   260   281
   288  H     -3.700000    6.080000   47.543000   260   281
   289  H     -5.380000    7.375000   43.495000   259   283
   290  P    -13.178000    8.962000   44.054000   343   268   291   292   293
   291  O    -14.144000    9.344000   42.993000   344   290
   292  O    -13.671000    8.310000   45.292000   344   290
   293  O    -12.063000    8.033000   43.404000   341   290   294
   294  C    -11.099000    8.599000   42.500000   337   293   295   301   302
   295  C    -10.275000    7.511000   41.855000   328   294   296   298   303
   296  O     -9.267000    7.016000   42.769000   332   295   297
   297  C     -9.305000    5.601000   42.777000   331   296   299   307   308
   298  C    -11.076000    6.292000   41.394000   329   295   299   300   304
   299  C    -10.736000    5.236000   42.431000   330   297   298   305   306
   300  O    -10.619000    5.884000   40.105000   338   298   320
   301  H    -10.454000    9.603000   42.575000   340   294
   302  H    -11.833000    8.980000   41.630000   340   294
   303  H     -9.635000    7.997000   40.971000   336   295
   304  H    -12.235000    6.507000   41.222000   335   298
   305  H    -10.767000    4.142000   41.962000   333   299
   306  H    -11.689000    5.163000   43.148000   333   299
   307  H     -8.548000    5.359000   41.889000   334   297
   308  N     -8.831000    5.138000   44.090000   262   297   309   315
   309  C     -7.597000    4.482000   44.160000   266   308   310   311
   310  O     -6.943000    4.320000   43.119000   270   309
   311  N     -7.149000    4.039000   45.356000   268   309   312
   312  C     -7.880000    4.232000   46.454000   267   311   313   314
   313  N     -7.398000    3.774000   47.611000   264   312   316   317
   314  C     -9.139000    4.903000   46.415000   263   312   315   318
   315  C     -9.572000    5.337000   45.222000   265   308   314   319
   316  H     -6.352000    3.206000   47.664000   272   313
   317  H     -7.862000    3.801000   48.707000   272   313
   318  H     -9.862000    4.756000   47.349000   269   314
   319  H    -10.752000    5.405000   45.349000   271   315
   320  P    -11.594000    5.053000   39.141000   343   300   321   322   323
   321  O    -11.628000    5.743000   37.831000   344   320
   322  O    -12.865000    4.793000   39.870000   344   320
   323  O    -10.825000    3.671000   38.964000   341   320   324
   324  C     -9.528000    3.640000   38.348000   337   323   325   331   332
   325  C     -8.879000    2.291000   38.548000   328   324   326   328   333
   326  O     -8.352000    2.162000   39.892000   332   325   327
   327  C     -8.783000    0.923000   40.428000   331   326   329   337   339
   328  C     -9.799000    1.087000   38.334000   329   325   329   330   334
   329  C    -10.109000    0.639000   39.752000   330   327   328   335   336
   330  O     -9.042000    0.047000   37.715000   347   328   338
   331  H     -9.805000    3.864000   37.210000   340   324
   332  H     -8.750000    4.530000   38.539000   340   324
   333  H     -7.859000    2.416000   37.937000   336   325
   334  H    -10.720000    1.074000   37.577000   335   328
   335  H    -11.208000    1.047000   39.943000   333   329
   336  H    -10.299000   -0.541000   39.788000   333   329
   337  H     -7.981000    0.080000   40.161000   334   327
   338  H     -7.920000    0.397000   37.606000   339   330
   339  N     -8.798000    1.033000   41.897000   262   327   340   346
   340  C     -7.693000    0.559000   42.606000   266   339   341   342
   341  O     -6.735000    0.093000   41.973000   270   340
   342  N     -7.693000    0.620000   43.956000   268   340   343
   343  C     -8.740000    1.138000   44.599000   267   342   344   345
   344  N     -8.699000    1.168000   45.935000   264   343   347   348
   345  C     -9.876000    1.644000   43.902000   263   343   346   349
   346  C     -9.864000    1.573000   42.562000   265   339   345   350
   347  H     -8.686000    1.621000   47.028000   272   344
   348  H     -8.923000    0.018000   46.156000   272   344
   349  H    -10.872000    1.636000   44.553000   269   345
   350  H    -10.995000    1.384000   42.247000   271   346
   351  O     24.371000   15.337000    2.193000   345   352   360
   352  C     24.362000   16.433000    3.084000   324   351   353   361   362
   353  C     23.527000   16.108000    4.331000   312   352   354   356   363
   354  O     24.084000   15.023000    5.056000   311   353   355
   355  C     23.852000   15.214000    6.447000   314   354   357   367   368
   356  C     23.490000   17.271000    5.325000   318   353   357   358   364
   357  C     23.081000   16.532000    6.599000   316   355   356   359   365
   358  O     22.580000   18.295000    4.943000   322   356   383
   359  O     21.694000   16.258000    6.626000   320   357   366
   360  H     24.826000   14.606000    2.617000   327   351
   361  H     23.931000   17.296000    2.573000   325   352
   362  H     25.389000   16.667000    3.369000   325   352
   363  H     22.508000   15.845000    4.037000   313   353
   364  H     24.506000   17.662000    5.438000   319   356
   365  H     23.357000   17.088000    7.494000   317   357
   366  H     21.485000   15.842000    7.466000   321   359
   367  H     23.272000   14.372000    6.832000   315   355
   368  N     25.133000   15.289000    7.196000   280   355   369   378
   369  C     26.410000   15.497000    6.733000   276   368   370   379
   370  N     27.323000   15.509000    7.663000   282   369   371
   371  C     26.607000   15.303000    8.837000   279   370   372   378
   372  C     27.062000   15.203000   10.195000   274   371   373   374
   373  O     28.216000   15.272000   10.607000   285   372
   374  N     26.017000   15.000000   11.107000   277   372   375   380
   375  C     24.675000   14.911000   10.749000   273   374   376   377
   376  N     23.793000   14.709000   11.736000   278   375   381   382
   377  N     24.252000   14.999000    9.469000   283   375   378
   378  C     25.260000   15.190000    8.562000   275   368   371   377
   379  H     26.644000   15.637000    5.687000   286   369
   380  H     26.268000   14.920000   12.082000   284   374
   381  H     24.111000   14.641000   12.692000   287   376
   382  H     22.810000   14.624000   11.524000   287   376
   383  P     22.609000   19.773000    5.610000   343   358   384   385   386
   384  O     21.498000   20.558000    5.026000   344   383
   385  O     23.993000   20.289000    5.512000   344   383
   386  O     22.288000   19.524000    7.177000   326   383   387
   387  C     20.980000   19.280000    7.671000   324   386   388   395   396
   388  C     21.026000   19.078000    9.194000   312   387   389   391   397
   389  O     21.890000   18.018000    9.576000   311   388   390
   390  C     22.405000   18.282000   10.879000   314   389   392   401   402
   391  C     21.546000   20.305000    9.943000   318   388   392   393   398
   392  C     21.895000   19.675000   11.293000   316   390   391   394   399
   393  O     20.567000   21.334000   10.008000   322   391   414
   394  O     20.745000   19.558000   12.111000   320   392   400
   395  H     20.545000   18.397000    7.203000   325   387
   396  H     20.338000   20.135000    7.453000   325   387
   397  H     20.021000   18.837000    9.549000   313   388
   398  H     22.460000   20.662000    9.464000   319   391
   399  H     22.647000   20.260000   11.823000   317   392
   400  H     20.407000   20.440000   12.280000   321   394
   401  H     21.996000   17.513000   11.539000   315   390
   402  N     23.904000   18.244000   10.922000   261   390   403   409
   403  C     24.530000   17.967000   12.153000   266   402   404   405
   404  O     23.870000   17.719000   13.162000   270   403
   405  N     25.899000   17.981000   12.212000   268   403   406
   406  C     26.647000   18.271000   11.128000   267   405   407   408
   407  N     27.981000   18.286000   11.246000   264   406   410   411
   408  C     26.029000   18.584000    9.861000   263   406   409   412
   409  C     24.671000   18.561000    9.813000   265   402   408   413
   410  H     28.410000   18.076000   12.136000   272   407
   411  H     28.559000   18.505000   10.448000   272   407
   412  H     26.590000   18.834000    8.971000   269   408
   413  H     24.192000   18.813000    8.880000   271   409
   414  P     20.911000   22.823000   10.541000   343   393   415   416   417
   415  O     19.671000   23.628000   10.486000   344   414
   416  O     22.123000   23.293000    9.832000   344   414
   417  O     21.277000   22.574000   12.097000   326   414   418
   418  C     22.212000   23.386000   12.786000   324   417   419   426   427
   419  C     22.446000   22.840000   14.202000   312   418   420   422   428
   420  O     22.886000   21.488000   14.171000   311   419   421
   421  C     24.022000   21.328000   15.009000   314   420   423   432   433
   422  C     23.534000   23.632000   14.938000   318   419   423   424   429
   423  C     24.057000   22.573000   15.905000   316   421   422   425   430
   424  O     23.021000   24.777000   15.607000   322   422   448
   425  O     23.177000   22.395000   17.000000   320   423   431
   426  H     21.837000   24.410000   12.854000   325   418
   427  H     23.163000   23.395000   12.249000   325   418
   428  H     21.514000   22.873000   14.771000   313   419
   429  H     24.327000   23.891000   14.231000   319   422
   430  H     25.052000   22.813000   16.275000   317   423
   431  H     23.062000   23.243000   17.435000   321   425
   432  H     23.917000   20.417000   15.602000   315   421
   433  N     25.264000   21.217000   14.197000   280   421   434   443
   434  C     25.441000   21.325000   12.837000   276   433   435   444
   435  N     26.668000   21.143000   12.437000   282   434   436
   436  C     27.367000   20.889000   13.609000   279   435   437   443
   437  C     28.757000   20.602000   13.814000   274   436   438   439
   438  O     29.634000   20.476000   12.963000   285   437
   439  N     29.090000   20.458000   15.168000   277   437   440   445
   440  C     28.176000   20.560000   16.212000   273   439   441   442
   441  N     28.640000   20.378000   17.455000   278   440   446   447
   442  N     26.863000   20.804000   16.012000   283   440   443
   443  C     26.520000   20.961000   14.696000   275   433   436   442
   444  H     24.640000   21.537000   12.146000   286   434
   445  H     30.054000   20.254000   15.384000   284   439
   446  H     29.623000   20.200000   17.609000   287   441
   447  H     28.007000   20.425000   18.240000   287   441
   448  P     23.875000   26.145000   15.764000   343   424   449   450   451
   449  O     23.161000   27.025000   16.718000   344   448
   450  O     24.185000   26.643000   14.406000   344   448
   451  O     25.266000   25.676000   16.444000   326   448   452
   452  C     25.380000   25.350000   17.820000   324   451   453   460   461
   453  C     26.827000   24.947000   18.146000   312   452   454   456   462
   454  O     27.229000   23.790000   17.430000   311   453   455
   455  C     28.633000   23.853000   17.188000   314   454   457   466   467
   456  C     27.864000   26.013000   17.784000   318   453   457   458   463
   457  C     29.138000   25.170000   17.799000   316   455   456   459   464
   458  O     27.879000   27.098000   18.700000   322   456   478
   459  O     29.599000   24.934000   19.117000   320   457   465
   460  H     24.712000   24.526000   18.076000   325   452
   461  H     25.116000   26.218000   18.429000   325   452
   462  H     26.890000   24.722000   19.213000   313   453
   463  H     27.679000   26.361000   16.765000   319   456
   464  H     29.937000   25.635000   17.221000   317   457
   465  H     28.901000   24.506000   19.617000   321   459
   466  H     29.085000   23.004000   17.706000   315   455
   467  N     28.984000   23.781000   15.735000   304   455   468   474
   468  C     30.314000   23.464000   15.415000   300   467   469   470
   469  O     31.175000   23.262000   16.269000   308   468
   470  N     30.632000   23.399000   14.058000   303   468   471   475
   471  C     29.761000   23.676000   13.005000   302   470   472   473
   472  O     30.154000   23.604000   11.843000   309   471
   473  C     28.412000   24.038000   13.420000   305   471   474   476
   474  C     28.070000   24.077000   14.736000   301   467   473   477
   475  H     31.581000   23.152000   13.818000   306   470
   476  H     27.670000   24.272000   12.671000   307   473
   477  H     27.057000   24.348000   14.991000   310   474
   478  P     28.617000   28.500000   18.363000   343   458   479   480   481
   479  O     28.435000   29.402000   19.523000   344   478
   480  O     28.169000   28.943000   17.023000   344   478
   481  O     30.185000   28.116000   18.252000   326   478   482
   482  C     31.018000   27.936000   19.388000   324   481   483   490   491
   483  C     32.476000   27.728000   18.949000   312   482   484   486   492
   484  O     32.665000   26.552000   18.182000   311   483   485
   485  C     33.817000   26.727000   17.357000   314   484   487   496   497
   486  C     32.990000   28.851000   18.048000   318   483   487   488   493
   487  C     34.254000   28.202000   17.485000   316   485   486   489   494
   488  O     33.195000   30.051000   18.779000   322   486   508
   489  O     35.344000   28.318000   18.382000   320   487   495
   490  H     30.687000   27.084000   19.982000   325   482
   491  H     30.982000   28.829000   20.015000   325   482
   492  H     33.102000   27.655000   19.842000   313   483
   493  H     32.281000   29.004000   17.230000   319   486
   494  H     34.536000   28.650000   16.533000   317   487
   495  H     35.094000   27.933000   19.225000   321   489
   496  H     34.589000   26.069000   17.762000   315   485
   497  N     33.536000   26.371000   15.929000   304   485   498   504
   498  C     34.599000   25.884000   15.148000   300   497   499   500
   499  O     35.741000   25.743000   15.576000   308   498
   500  N     34.300000   25.554000   13.826000   303   498   501   505
   501  C     33.053000   25.683000   13.215000   302   500   502   503
   502  O     32.895000   25.322000   12.051000   309   501
   503  C     32.025000   26.261000   14.068000   305   501   504   506
   504  C     32.287000   26.576000   15.365000   301   497   503   507
   505  H     35.052000   25.179000   13.265000   306   500
   506  H     31.036000   26.433000   13.668000   307   503
   507  H     31.492000   27.004000   15.958000   310   504
   508  P     33.293000   31.500000   18.064000   343   488   509   510   511
   509  O     33.368000   32.525000   19.129000   344   508
   510  O     32.228000   31.588000   17.038000   344   508
   511  O     34.720000   31.461000   17.315000   326   508   512
   512  C     35.117000   32.486000   16.418000   324   511   513   520   521
   513  C     36.563000   32.266000   15.954000   312   512   514   516   522
   514  O     37.471000   32.340000   17.040000   311   513   515
   515  C     38.583000   31.492000   16.779000   314   514   517   526   527
   516  C     36.805000   30.900000   15.308000   318   513   517   518   523
   517  C     38.328000   30.818000   15.421000   316   515   516   519   524
   518  O     36.327000   30.854000   13.969000   322   516   541
   519  O     38.965000   31.560000   14.396000   320   517   525
   520  H     35.050000   33.461000   16.905000   325   512
   521  H     34.462000   32.484000   15.544000   325   512
   522  H     36.824000   33.057000   15.247000   313   513
   523  H     36.359000   30.119000   15.928000   319   516
   524  H     38.682000   29.789000   15.390000   317   517
   525  H     38.676000   32.474000   14.451000   321   519
   526  H     39.487000   32.105000   16.744000   315   515
   527  N     38.750000   30.489000   17.865000   251   515   528   536
   528  C     37.915000   30.187000   18.917000   248   527   529   537
   529  N     38.413000   29.341000   19.776000   255   528   530
   530  C     39.670000   29.045000   19.261000   250   529   531   536
   531  C     40.746000   28.230000   19.711000   249   530   532   533
   532  N     40.719000   27.551000   20.867000   253   531   538   539
   533  N     41.862000   28.141000   18.943000   257   531   534
   534  C     41.916000   28.830000   17.796000   254   533   535   540
   535  N     40.986000   29.645000   17.281000   256   534   536
   536  C     39.870000   29.715000   18.072000   247   527   530   535
   537  H     36.936000   30.627000   19.042000   258   528
   538  H     41.514000   26.992000   21.139000   260   532
   539  H     39.905000   27.597000   21.463000   260   532
   540  H     42.825000   28.725000   17.221000   259   534
   541  P     35.941000   29.467000   13.226000   343   518   542   543   544
   542  O     35.750000   29.757000   11.788000   344   541
   543  O     34.846000   28.828000   13.989000   344   541
   544  O     37.262000   28.550000   13.393000   326   541   545
   545  C     38.395000   28.670000   12.547000   324   544   546   553   554
   546  C     39.479000   27.664000   12.965000   312   545   547   549   555
   547  O     40.026000   27.952000   14.242000   311   546   548
   548  C     40.405000   26.735000   14.874000   314   547   550   559   560
   549  C     38.964000   26.227000   13.057000   318   546   550   551   556
   550  C     40.080000   25.596000   13.890000   316   548   549   552   557
   551  O     38.790000   25.657000   11.766000   322   549   574
   552  O     41.213000   25.314000   13.089000   320   550   558
   553  H     38.805000   29.680000   12.586000   325   545
   554  H     38.104000   28.452000   11.518000   325   545
   555  H     40.296000   27.711000   12.240000   313   546
   556  H     38.037000   26.203000   13.635000   319   549
   557  H     39.755000   24.682000   14.389000   317   550
   558  H     40.942000   24.723000   12.383000   321   552
   559  H     41.474000   26.768000   15.098000   315   548
   560  N     39.646000   26.558000   16.142000   251   548   561   569
   561  C     38.370000   26.963000   16.459000   248   560   562   570
   562  N     37.946000   26.560000   17.624000   255   561   563
   563  C     39.021000   25.845000   18.137000   250   562   564   569
   564  C     39.236000   25.146000   19.356000   249   563   565   566
   565  N     38.301000   25.035000   20.310000   253   564   571   572
   566  N     40.447000   24.572000   19.574000   257   564   567
   567  C     41.390000   24.670000   18.628000   254   566   568   573
   568  N     41.301000   25.277000   17.438000   256   567   569
   569  C     40.075000   25.857000   17.246000   247   560   563   568
   570  H     37.754000   27.551000   15.796000   258   561
   571  H     38.508000   24.528000   21.158000   260   565
   572  H     37.391000   25.453000   20.180000   260   565
   573  H     42.334000   24.193000   18.848000   259   567
   574  P     37.741000   24.459000   11.478000   343   551   575   576   577
   575  O     37.880000   24.049000   10.062000   344   574
   576  O     36.415000   24.868000   11.990000   344   574
   577  O     38.286000   23.260000   12.410000   326   574   578
   578  C     39.492000   22.567000   12.142000   324   577   579   586   587
   579  C     39.202000   21.065000   12.006000   312   578   580   582   588
   580  O     38.339000   20.882000   10.896000   311   579   581
   581  C     38.660000   19.682000   10.217000   314   580   583   592   593
   582  C     40.443000   20.200000   11.742000   318   579   583   584   589
   583  C     39.819000   19.026000   10.979000   316   581   582   585   590
   584  O     41.113000   19.711000   12.903000   322   582   608
   585  O     39.284000   18.061000   11.871000   320   583   591
   586  H     40.148000   22.757000   12.983000   325   578
   587  H     39.995000   22.925000   11.241000   325   578
   588  H     38.695000   20.684000   12.893000   313   579
   589  H     41.135000   20.726000   11.081000   319   582
   590  H     40.544000   18.539000   10.322000   317   583
   591  H     38.655000   18.498000   12.451000   321   585
   592  H     37.774000   19.044000   10.234000   315   581
   593  N     38.998000   19.967000    8.798000   280   581   594   603
   594  C     39.435000   21.135000    8.216000   276   593   595   604
   595  N     39.517000   21.088000    6.915000   282   594   596
   596  C     39.121000   19.793000    6.599000   279   595   597   603
   597  C     38.982000   19.150000    5.322000   274   596   598   599
   598  O     39.167000   19.636000    4.208000   285   597
   599  N     38.578000   17.809000    5.424000   277   597   600   605
   600  C     38.322000   17.164000    6.632000   273   599   601   602
   601  N     37.957000   15.875000    6.571000   278   600   606   607
   602  N     38.429000   17.782000    7.830000   283   600   603
   603  C     38.831000   19.089000    7.750000   275   593   596   602
   604  H     39.671000   22.027000    8.781000   286   594
   605  H     38.460000   17.294000    4.562000   284   599
   606  H     37.877000   15.413000    5.677000   287   601
   607  H     37.768000   15.361000    7.420000   287   601
   608  P     41.808000   20.651000   14.025000   343   584   609   610   611
   609  O     42.437000   21.810000   13.351000   344   608
   610  O     42.634000   19.775000   14.887000   344   608
   611  O     40.553000   21.174000   14.913000   326   608   612
   612  C     40.744000   21.985000   16.062000   324   611   613   620   621
   613  C     39.448000   22.187000   16.866000   312   612   614   616   622
   614  O     38.501000   23.038000   16.238000   311   613   615
   615  C     37.219000   22.795000   16.826000   314   614   617   626   627
   616  C     38.654000   20.914000   17.154000   318   613   617   618   623
   617  C     37.371000   21.541000   17.704000   316   615   616   619   624
   618  O     39.302000   20.032000   18.062000   322   616   638
   619  O     37.510000   21.925000   19.061000   320   617   625
   620  H     41.145000   22.958000   15.768000   325   612
   621  H     41.466000   21.502000   16.726000   325   612
   622  H     39.730000   22.646000   17.812000   313   613
   623  H     38.441000   20.412000   16.208000   319   616
   624  H     36.531000   20.858000   17.607000   317   617
   625  H     38.226000   22.560000   19.135000   321   619
   626  H     36.976000   23.669000   17.438000   315   615
   627  N     36.138000   22.583000   15.812000   304   615   628   634
   628  C     34.807000   22.838000   16.188000   300   627   629   630
   629  O     34.482000   23.186000   17.322000   308   628
   630  N     33.842000   22.680000   15.191000   303   628   631   635
   631  C     34.082000   22.257000   13.883000   302   630   632   633
   632  O     33.163000   22.203000   13.069000   309   631
   633  C     35.467000   21.899000   13.615000   305   631   634   636
   634  C     36.425000   22.066000   14.564000   301   627   633   637
   635  H     32.887000   22.895000   15.437000   306   630
   636  H     35.739000   21.500000   12.648000   307   633
   637  H     37.438000   21.780000   14.339000   310   634
   638  P     38.822000   18.494000   18.264000   343   618   639   640   641
   639  O     39.707000   17.868000   19.271000   344   638
   640  O     38.692000   17.876000   16.925000   344   638
   641  O     37.336000   18.613000   18.897000   326   638   642
   642  C     37.103000   18.918000   20.263000   324   641   643   650   651
   643  C     35.609000   19.191000   20.498000   312   642   644   646   652
   644  O     35.138000   20.238000   19.662000   311   643   645
   645  C     33.751000   20.053000   19.407000   314   644   647   656   657
   646  C     34.687000   18.008000   20.197000   318   643   647   648   653
   647  C     33.348000   18.745000   20.108000   316   645   646   649   654
   648  O     34.731000   16.996000   21.195000   322   646   669
   649  O     32.828000   19.037000   21.392000   320   647   655
   650  H     37.671000   19.802000   20.558000   325   642
   651  H     37.417000   18.079000   20.888000   325   642
   652  H     35.470000   19.497000   21.538000   313   643
   653  H     34.947000   17.592000   19.223000   319   646
   654  H     32.609000   18.177000   19.548000   317   647
   655  H     31.971000   19.457000   21.285000   321   649
   656  H     33.241000   20.906000   19.860000   315   645
   657  N     33.439000   19.972000   17.942000   261   645   658   664
   658  C     32.189000   20.444000   17.500000   266   657   659   660
   659  O     31.414000   21.016000   18.265000   270   658
   660  N     31.838000   20.243000   16.192000   268   658   661
   661  C     32.652000   19.604000   15.330000   267   660   662   663
   662  N     32.231000   19.404000   14.074000   264   661   665   666
   663  C     33.943000   19.118000   15.754000   263   661   664   667
   664  C     34.282000   19.320000   17.055000   265   657   663   668
   665  H     31.322000   19.742000   13.791000   272   662
   666  H     32.817000   18.916000   13.412000   272   662
   667  H     34.630000   18.602000   15.097000   269   663
   668  H     35.232000   18.941000   17.393000   271   664
   669  P     34.148000   15.503000   20.943000   343   648   670   671   672
   670  O     34.362000   14.715000   22.178000   344   669
   671  O     34.694000   15.006000   19.660000   344   669
   672  O     32.556000   15.720000   20.749000   326   669   673
   673  C     31.684000   15.976000   21.838000   324   672   674   681   682
   674  C     30.265000   16.257000   21.325000   312   673   675   677   683
   675  O     30.232000   17.335000   20.402000   311   674   676
   676  C     29.157000   17.134000   19.490000   314   675   678   687   688
   677  C     29.631000   15.081000   20.578000   318   674   678   679   684
   678  C     28.483000   15.809000   19.877000   316   676   677   680   685
   679  O     29.211000   14.038000   21.448000   322   677   703
   680  O     27.401000   16.061000   20.754000   320   678   686
   681  H     32.029000   16.837000   22.412000   325   673
   682  H     31.653000   15.109000   22.501000   325   673
   683  H     29.639000   16.523000   22.181000   313   674
   684  H     30.340000   14.714000   19.832000   319   677
   685  H     28.120000   15.255000   19.015000   317   678
   686  H     27.722000   16.561000   21.508000   321   680
   687  H     28.458000   17.968000   19.584000   315   676
   688  N     29.631000   17.078000   18.081000   280   676   689   698
   689  C     30.889000   16.841000   17.577000   276   688   690   699
   690  N     30.966000   16.891000   16.276000   282   689   691
   691  C     29.664000   17.157000   15.873000   279   690   692   698
   692  C     29.113000   17.321000   14.558000   274   691   693   694
   693  O     29.711000   17.301000   13.485000   285   692
   694  N     27.726000   17.525000   14.567000   277   692   695   700
   695  C     26.953000   17.568000   15.724000   273   694   696   697
   696  N     25.640000   17.786000   15.577000   278   695   701   702
   697  N     27.477000   17.425000   16.961000   283   695   698
   698  C     28.831000   17.226000   16.972000   275   688   691   697
   699  H     31.747000   16.627000   18.194000   286   689
   700  H     27.270000   17.646000   13.674000   284   694
   701  H     25.243000   17.898000   14.655000   287   696
   702  H     25.045000   17.837000   16.392000   287   696
   703  P     28.881000   12.543000   20.914000   343   679   704   705   706
   704  O     28.454000   11.728000   22.075000   344   703
   705  O     30.022000   12.089000   20.088000   344   703
   706  O     27.608000   12.738000   19.935000   326   703   707
   707  C     26.291000   12.932000   20.423000   324   706   708   715   716
   708  C     25.326000   13.215000   19.263000   312   707   709   711   717
   709  O     25.708000   14.357000   18.509000   311   708   710
   710  C     25.255000   14.206000   17.165000   314   709   712   721   722
   711  C     25.231000   12.089000   18.231000   318   708   712   713   718
   712  C     24.544000   12.844000   17.092000   316   710   711   714   719
   713  O     24.504000   10.960000   18.699000   322   711   734
   714  O     23.156000   13.007000   17.325000   320   712   720
   715  H     26.261000   13.770000   21.121000   325   707
   716  H     25.958000   12.034000   20.946000   325   707
   717  H     24.337000   13.403000   19.688000   313   708
   718  H     26.241000   11.803000   17.927000   319   711
   719  H     24.678000   12.346000   16.135000   317   712
   720  H     23.032000   13.482000   18.149000   321   714
   721  H     24.552000   15.020000   16.974000   315   710
   722  N     26.365000   14.251000   16.156000   261   710   723   729
   723  C     26.032000   14.566000   14.825000   266   722   724   725
   724  O     24.880000   14.860000   14.509000   270   723
   725  N     27.020000   14.537000   13.877000   268   723   726
   726  C     28.287000   14.201000   14.188000   267   725   727   728
   727  N     29.206000   14.180000   13.214000   264   726   730   731
   728  C     28.651000   13.852000   15.541000   263   726   729   732
   729  C     27.663000   13.887000   16.475000   265   722   728   733
   730  H     28.939000   14.422000   12.271000   272   727
   731  H     30.161000   13.924000   13.420000   272   727
   732  H     29.652000   13.568000   15.833000   269   728
   733  H     27.913000   13.601000   17.483000   271   729
   734  P     24.617000    9.505000   17.991000   343   713   735   736   737
   735  O     23.729000    8.574000   18.722000   344   734
   736  O     26.053000    9.176000   17.847000   344   734
   737  O     24.011000    9.727000   16.505000   326   734   738
   738  C     22.618000    9.831000   16.259000   324   737   739   746   747
   739  C     22.353000   10.100000   14.770000   312   738   740   742   748
   740  O     22.975000   11.293000   14.318000   311   739   741
   741  C     23.306000   11.156000   12.939000   314   740   743   752   754
   742  C     22.866000    9.004000   13.833000   318   739   743   744   749
   743  C     22.852000    9.752000   12.501000   316   741   742   745   750
   744  O     22.049000    7.849000   13.828000   346   742   753
   745  O     21.541000    9.813000   11.966000   320   743   751
   746  H     22.187000   10.642000   16.848000   325   738
   747  H     22.122000    8.899000   16.539000   325   738
   748  H     21.275000   10.211000   14.627000   313   739
   749  H     23.892000    8.730000   14.086000   319   742
   750  H     23.515000    9.289000   11.768000   317   743
   751  H     21.228000    8.915000   11.831000   321   745
   752  H     22.781000   11.928000   12.372000   315   741
   753  H     22.384000    7.243000   13.163000   323   744
   754  N     24.770000   11.324000   12.721000   251   741   755   763
   755  C     25.812000   11.222000   13.614000   248   754   756   764
   756  N     26.992000   11.419000   13.094000   255   755   757
   757  C     26.729000   11.651000   11.749000   250   756   758   763
   758  C     27.554000   11.913000   10.621000   249   757   759   760
   759  N     28.886000   12.042000   10.700000   253   758   765   766
   760  N     26.971000   12.038000    9.402000   257   758   761
   761  C     25.641000   11.923000    9.304000   254   760   762   767
   762  N     24.760000   11.697000   10.287000   256   761   763
   763  C     25.372000   11.569000   11.507000   247   754   757   762
   764  H     25.680000   10.991000   14.660000   258   755
   765  H     29.421000   12.237000    9.867000   260   759
   766  H     29.353000   11.956000   11.592000   260   759
   767  H     25.226000   12.032000    8.313000   259   761