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📄 methanol.pdb

📁 最著名最快的分子模拟软件
💻 PDB
📖 第 1 页 / 共 3 页
字号:
ATOM    435  H3  MeO   145      10.010  10.610   8.940  1.00  0.00ATOM    436  Me1 MeO   146       3.460  14.390   4.780  1.00  0.00ATOM    437  O2  MeO   146       4.190  15.540   4.750  1.00  0.00ATOM    438  H3  MeO   146       4.540  15.660   3.820  1.00  0.00ATOM    439  Me1 MeO   147      11.500   1.860   5.190  1.00  0.00ATOM    440  O2  MeO   147      11.570   3.120   4.680  1.00  0.00ATOM    441  H3  MeO   147      11.020   3.670   5.300  1.00  0.00ATOM    442  Me1 MeO   148       6.650  17.090   2.520  1.00  0.00ATOM    443  O2  MeO   148       5.350  17.050   2.910  1.00  0.00ATOM    444  H3  MeO   148       4.970  17.980   2.850  1.00  0.00ATOM    445  Me1 MeO   149      15.430  20.990  18.360  1.00  0.00ATOM    446  O2  MeO   149      14.940  22.250  18.520  1.00  0.00ATOM    447  H3  MeO   149      15.530  22.780  19.130  1.00  0.00ATOM    448  Me1 MeO   150      11.840  20.870  19.400  1.00  0.00ATOM    449  O2  MeO   150      12.360  22.130  19.350  1.00  0.00ATOM    450  H3  MeO   150      13.260  22.010  18.930  1.00  0.00ATOM    451  Me1 MeO   151       7.980   5.220  21.180  1.00  0.00ATOM    452  O2  MeO   151       8.290   5.600  22.450  1.00  0.00ATOM    453  H3  MeO   151       9.170   5.240  22.750  1.00  0.00ATOM    454  Me1 MeO   152       6.910  15.360  21.400  1.00  0.00ATOM    455  O2  MeO   152       7.160  15.750  22.680  1.00  0.00ATOM    456  H3  MeO   152       8.110  15.520  22.890  1.00  0.00ATOM    457  Me1 MeO   153      11.900  18.310  15.300  1.00  0.00ATOM    458  O2  MeO   153      11.630  17.250  16.100  1.00  0.00ATOM    459  H3  MeO   153      12.400  16.710  16.430  1.00  0.00ATOM    460  Me1 MeO   154      13.100   7.960  13.570  1.00  0.00ATOM    461  O2  MeO   154      12.690   8.020  14.870  1.00  0.00ATOM    462  H3  MeO   154      11.890   7.440  14.950  1.00  0.00ATOM    463  Me1 MeO   155       6.460   4.780  14.090  1.00  0.00ATOM    464  O2  MeO   155       6.090   3.480  14.230  1.00  0.00ATOM    465  H3  MeO   155       6.840   2.880  13.960  1.00  0.00ATOM    466  Me1 MeO   156       7.440  14.990  10.090  1.00  0.00ATOM    467  O2  MeO   156       7.220  16.000   9.200  1.00  0.00ATOM    468  H3  MeO   156       6.390  15.770   8.700  1.00  0.00ATOM    469  Me1 MeO   157      15.250  18.900   9.840  1.00  0.00ATOM    470  O2  MeO   157      13.890  18.810   9.910  1.00  0.00ATOM    471  H3  MeO   157      13.660  17.850  10.000  1.00  0.00ATOM    472  Me1 MeO   158       0.830   2.590  16.930  1.00  0.00ATOM    473  O2  MeO   158       1.160   3.620  16.100  1.00  0.00ATOM    474  H3  MeO   158       2.160   3.550  16.100  1.00  0.00ATOM    475  Me1 MeO   159      17.840   0.750  18.780  1.00  0.00ATOM    476  O2  MeO   159      17.030  -0.130  19.430  1.00  0.00ATOM    477  H3  MeO   159      17.360  -0.410  20.330  1.00  0.00ATOM    478  Me1 MeO   160      11.700   4.610  22.560  1.00  0.00ATOM    479  O2  MeO   160      10.430   4.320  22.950  1.00  0.00ATOM    480  H3  MeO   160      10.420   3.750  23.770  1.00  0.00ATOM    481  Me1 MeO   161      13.020  16.900  -0.330  1.00  0.00ATOM    482  O2  MeO   161      12.830  15.610   0.050  1.00  0.00ATOM    483  H3  MeO   161      13.500  15.340   0.750  1.00  0.00ATOM    484  Me1 MeO   162       8.960   2.810   9.150  1.00  0.00ATOM    485  O2  MeO   162       8.230   3.180   8.060  1.00  0.00ATOM    486  H3  MeO   162       7.460   3.730   8.390  1.00  0.00ATOM    487  Me1 MeO   163      18.360  18.040  17.560  1.00  0.00ATOM    488  O2  MeO   163      18.690  16.820  18.060  1.00  0.00ATOM    489  H3  MeO   163      19.680  16.920  18.180  1.00  0.00ATOM    490  Me1 MeO   164       7.310   7.780   9.440  1.00  0.00ATOM    491  O2  MeO   164       8.280   8.490  10.070  1.00  0.00ATOM    492  H3  MeO   164       8.340   9.370   9.600  1.00  0.00ATOM    493  Me1 MeO   165       5.080  16.850  18.400  1.00  0.00ATOM    494  O2  MeO   165       4.390  16.930  17.240  1.00  0.00ATOM    495  H3  MeO   165       4.980  17.100  16.450  1.00  0.00ATOM    496  Me1 MeO   166      10.760  10.330  15.780  1.00  0.00ATOM    497  O2  MeO   166      12.060  10.740  15.690  1.00  0.00ATOM    498  H3  MeO   166      12.660   9.960  15.520  1.00  0.00ATOM    499  Me1 MeO   167      12.500  11.070  24.280  1.00  0.00ATOM    500  O2  MeO   167      12.500  10.180  23.240  1.00  0.00ATOM    501  H3  MeO   167      11.540  10.070  22.970  1.00  0.00ATOM    502  Me1 MeO   168       2.020  22.590   1.320  1.00  0.00ATOM    503  O2  MeO   168       2.060  23.660   2.160  1.00  0.00ATOM    504  H3  MeO   168       1.740  23.340   3.060  1.00  0.00ATOM    505  Me1 MeO   169       2.000  14.240   1.160  1.00  0.00ATOM    506  O2  MeO   169       1.870  13.230   2.060  1.00  0.00ATOM    507  H3  MeO   169       1.140  13.610   2.630  1.00  0.00ATOM    508  Me1 MeO   170      15.640  19.590  13.190  1.00  0.00ATOM    509  O2  MeO   170      16.990  19.640  12.970  1.00  0.00ATOM    510  H3  MeO   170      17.200  18.690  12.740  1.00  0.00ATOM    511  Me1 MeO   171      20.640  10.520  12.820  1.00  0.00ATOM    512  O2  MeO   171      19.790   9.750  13.550  1.00  0.00ATOM    513  H3  MeO   171      20.340   9.460  14.330  1.00  0.00ATOM    514  Me1 MeO   172      19.960  22.900  22.420  1.00  0.00ATOM    515  O2  MeO   172      18.750  23.210  21.860  1.00  0.00ATOM    516  H3  MeO   172      18.180  23.670  22.540  1.00  0.00ATOM    517  Me1 MeO   173      15.190  24.140   3.360  1.00  0.00ATOM    518  O2  MeO   173      14.330  23.090   3.410  1.00  0.00ATOM    519  H3  MeO   173      14.300  22.450   2.640  1.00  0.00ATOM    520  Me1 MeO   174      11.750  13.330   3.370  1.00  0.00ATOM    521  O2  MeO   174      10.610  14.050   3.200  1.00  0.00ATOM    522  H3  MeO   174      10.950  14.980   3.060  1.00  0.00ATOM    523  Me1 MeO   175      12.630   8.590   4.060  1.00  0.00ATOM    524  O2  MeO   175      13.890   8.760   4.530  1.00  0.00ATOM    525  H3  MeO   175      14.550   8.960   3.800  1.00  0.00ATOM    526  Me1 MeO   176       6.610  23.240  17.460  1.00  0.00ATOM    527  O2  MeO   176       6.790  22.020  18.050  1.00  0.00ATOM    528  H3  MeO   176       5.870  21.660  18.210  1.00  0.00ATOM    529  Me1 MeO   177      15.550   7.060  16.780  1.00  0.00ATOM    530  O2  MeO   177      14.260   7.450  16.980  1.00  0.00ATOM    531  H3  MeO   177      13.780   7.310  16.110  1.00  0.00ATOM    532  Me1 MeO   178      19.560  11.930   3.430  1.00  0.00ATOM    533  O2  MeO   178      18.950  11.610   4.610  1.00  0.00ATOM    534  H3  MeO   178      19.440  10.880   5.080  1.00  0.00ATOM    535  Me1 MeO   179      14.490   2.940   7.190  1.00  0.00ATOM    536  O2  MeO   179      15.500   3.230   8.060  1.00  0.00ATOM    537  H3  MeO   179      15.070   3.790   8.770  1.00  0.00ATOM    538  Me1 MeO   180      14.650   1.530  11.870  1.00  0.00ATOM    539  O2  MeO   180      13.410   1.010  12.070  1.00  0.00ATOM    540  H3  MeO   180      13.210   1.220  13.030  1.00  0.00ATOM    541  Me1 MeO   181      16.680  14.850   5.940  1.00  0.00ATOM    542  O2  MeO   181      16.190  13.990   6.870  1.00  0.00ATOM    543  H3  MeO   181      15.390  13.500   6.510  1.00  0.00ATOM    544  Me1 MeO   182      16.600   7.530   3.550  1.00  0.00ATOM    545  O2  MeO   182      16.140   8.690   3.020  1.00  0.00ATOM    546  H3  MeO   182      16.770   9.010   2.310  1.00  0.00ATOM    547  Me1 MeO   183      17.500   9.690  -0.020  1.00  0.00ATOM    548  O2  MeO   183      17.990   9.480   1.230  1.00  0.00ATOM    549  H3  MeO   183      18.990   9.360   1.200  1.00  0.00ATOM    550  Me1 MeO   184      11.150  16.220  19.730  1.00  0.00ATOM    551  O2  MeO   184      11.280  17.560  19.960  1.00  0.00ATOM    552  H3  MeO   184      10.330  17.850  19.900  1.00  0.00ATOM    553  Me1 MeO   185      18.460   6.140   0.640  1.00  0.00ATOM    554  O2  MeO   185      18.910   5.110   1.400  1.00  0.00ATOM    555  H3  MeO   185      18.120   4.600   1.740  1.00  0.00ATOM    556  Me1 MeO   186      15.240  10.100  19.960  1.00  0.00ATOM    557  O2  MeO   186      15.480   8.780  20.200  1.00  0.00ATOM    558  H3  MeO   186      14.830   8.470  20.890  1.00  0.00ATOM    559  Me1 MeO   187      20.440   0.940  15.750  1.00  0.00ATOM    560  O2  MeO   187      20.620   1.590  14.570  1.00  0.00ATOM    561  H3  MeO   187      21.310   2.320  14.640  1.00  0.00ATOM    562  Me1 MeO   188      23.160  21.750   4.270  1.00  0.00ATOM    563  O2  MeO   188      23.750  22.960   4.060  1.00  0.00ATOM    564  H3  MeO   188      23.020  23.630   3.940  1.00  0.00ATOM    565  Me1 MeO   189       6.760  11.990   0.580  1.00  0.00ATOM    566  O2  MeO   189       5.630  11.380   0.140  1.00  0.00ATOM    567  H3  MeO   189       5.010  11.400   0.920  1.00  0.00ATOM    568  Me1 MeO   190       3.790  13.880  10.140  1.00  0.00ATOM    569  O2  MeO   190       2.920  14.220  11.130  1.00  0.00ATOM    570  H3  MeO   190       3.430  14.430  11.960  1.00  0.00ATOM    571  Me1 MeO   191       9.990  13.670  23.280  1.00  0.00ATOM    572  O2  MeO   191       9.800  15.020  23.200  1.00  0.00ATOM    573  H3  MeO   191      10.690  15.460  23.330  1.00  0.00ATOM    574  Me1 MeO   192      12.900   4.610  15.920  1.00  0.00ATOM    575  O2  MeO   192      12.660   3.310  16.250  1.00  0.00ATOM    576  H3  MeO   192      11.770   3.350  16.710  1.00  0.00ATOM    577  Me1 MeO   193      21.610  22.100  19.370  1.00  0.00ATOM    578  O2  MeO   193      21.730  20.750  19.450  1.00  0.00ATOM    579  H3  MeO   193      20.840  20.380  19.690  1.00  0.00ATOM    580  Me1 MeO   194      16.990   7.050   8.640  1.00  0.00ATOM    581  O2  MeO   194      17.910   7.000   9.640  1.00  0.00ATOM    582  H3  MeO   194      18.290   7.920   9.660  1.00  0.00ATOM    583  Me1 MeO   195      20.160  17.020  22.070  1.00  0.00ATOM    584  O2  MeO   195      19.150  17.300  21.210  1.00  0.00ATOM    585  H3  MeO   195      19.180  16.470  20.650  1.00  0.00ATOM    586  Me1 MeO   196      12.230   0.830   8.890  1.00  0.00ATOM    587  O2  MeO   196      11.720   0.940  10.150  1.00  0.00ATOM    588  H3  MeO   196      12.460   0.700  10.780  1.00  0.00ATOM    589  Me1 MeO   197       8.730  22.760  11.150  1.00  0.00ATOM    590  O2  MeO   197       9.450  23.850  11.510  1.00  0.00ATOM    591  H3  MeO   197      10.270  23.850  10.940  1.00  0.00ATOM    592  Me1 MeO   198      16.500   3.950  20.420  1.00  0.00ATOM    593  O2  MeO   198      17.500   3.780  21.320  1.00  0.00ATOM    594  H3  MeO   198      18.340   3.780  20.790  1.00  0.00ATOM    595  Me1 MeO   199       9.970   6.100  17.140  1.00  0.00ATOM    596  O2  MeO   199      10.090   6.780  15.960  1.00  0.00ATOM    597  H3  MeO   199       9.270   7.340  15.930  1.00  0.00ATOM    598  Me1 MeO   200       1.590  10.610  16.780  1.00  0.00ATOM    599  O2  MeO   200       2.350  10.530  15.660  1.00  0.00ATOM    600  H3  MeO   200       2.090  11.160  14.930  1.00  0.00ATOM    601  Me1 MeO   201      23.780   3.470  20.370  1.00  0.00ATOM    602  O2  MeO   201      22.740   3.000  21.110  1.00  0.00ATOM    603  H3  MeO   201      23.250   2.440  21.770  1.00  0.00ATOM    604  Me1 MeO   202      18.200   2.400  12.390  1.00  0.00ATOM    605  O2  MeO   202      18.320   2.310  13.740  1.00  0.00ATOM    606  H3  MeO   202      19.120   1.740  13.940  1.00  0.00ATOM    607  Me1 MeO   203      14.210   2.280  24.100  1.00  0.00ATOM    608  O2  MeO   203      14.700   1.370  23.220  1.00  0.00ATOM    609  H3  MeO   203      15.620   1.580  22.870  1.00  0.00ATOM    610  Me1 MeO   204       3.180  15.970  14.080  1.00  0.00ATOM    611  O2  MeO   204       3.570  14.740  13.660  1.00  0.00ATOM    612  H3  MeO   204       4.420  14.410  14.060  1.00  0.00ATOM    613  Me1 MeO   205       4.200  21.440   8.900  1.00  0.00ATOM    614  O2  MeO   205       4.530  21.260   7.600  1.00  0.00ATOM    615  H3  MeO   205       5.280  21.910   7.450  1.00  0.00ATOM    616  Me1 MeO   206       0.050  17.490   2.850  1.00  0.00ATOM    617  O2  MeO   206       0.580  18.720   2.590  1.00  0.00ATOM    618  H3  MeO   206       0.000  19.120   1.880  1.00  0.00ATOM    619  Me1 MeO   207       4.570   3.360  17.260  1.00  0.00ATOM    620  O2  MeO   207       3.800   3.460  16.140  1.00  0.00ATOM    621  H3  MeO   207       4.420   3.670  15.380  1.00  0.00ATOM    622  Me1 MeO   208      18.690   2.660   8.370  1.00  0.00ATOM    623  O2  MeO   208      17.970   2.200   7.320  1.00  0.00ATOM    624  H3  MeO   208      16.990   2.380   7.450  1.00  0.00ATOM    625  Me1 MeO   209      10.710  17.470   3.150  1.00  0.00ATOM    626  O2  MeO   209      11.470  16.450   2.660  1.00  0.00ATOM    627  H3  MeO   209      12.340  16.750   2.280  1.00  0.00ATOM    628  Me1 MeO   210       8.240   2.050  22.920  1.00  0.00ATOM    629  O2  MeO   210       7.560   1.780  21.780  1.00  0.00ATOM    630  H3  MeO   210       7.990   0.930  21.450  1.00  0.00ATOM    631  Me1 MeO   211       0.260   8.120  14.050  1.00  0.00ATOM    632  O2  MeO   211       0.470   7.620  12.800  1.00  0.00ATOM    633  H3  MeO   211      -0.320   7.890  12.250  1.00  0.00ATOM    634  Me1 MeO   212       1.430  18.910   7.030  1.00  0.00ATOM    635  O2  MeO   212       0.790  19.400   8.130  1.00  0.00ATOM    636  H3  MeO   212       1.070  18.990   8.990  1.00  0.00ATOM    637  Me1 MeO   213      16.550   9.340  12.770  1.00  0.00ATOM    638  O2  MeO   213      17.460   8.730  13.580  1.00  0.00ATOM    639  H3  MeO   213      18.270   9.300  13.610  1.00  0.00ATOM    640  Me1 MeO   214       0.860  22.820   9.750  1.00  0.00ATOM    641  O2  MeO   214       0.450  21.560  10.060  1.00  0.00ATOM    642  H3  MeO   214       0.570  21.000   9.240  1.00  0.00ATOM    643  Me1 MeO   215      16.880  16.200  12.960  1.00  0.00ATOM    644  O2  MeO   215      17.780  17.140  12.560  1.00  0.00ATOM    645  H3  MeO   215      18.060  16.950  11.610  1.00  0.00ATOM    646  Me1 MeO   216      17.380  10.250  16.520  1.00  0.00ATOM    647  O2  MeO   216      18.580   9.760  16.940  1.00  0.00ATOM    648  H3  MeO   216      18.360   9.290  17.790  1.00  0.00TERENDMDL

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