51
     1  CA    15.484876   22.732976   48.954424   501     2     6    27
     2  CA    15.397751   22.356826   47.585172   502     1     3     7
     3  CA    15.546139   20.985464   47.247068   503     2     4    22
     4  CA    15.763943   20.025445   48.244590   504     3     5    42
     5  CA    15.840316   20.404823   49.578275   505     4     6    23
     6  CA    15.698791   21.749843   49.941639   506     1     5    43
     7  CT    15.270056   23.393591   46.449440   507     2     8    40    41
     8  CA    14.100171   24.377745   46.381696   508     7     9    13
     9  CA    14.026162   25.216286   45.249476   509     8    10    36
    10  CA    12.899297   26.025880   45.004394   510     9    11    14
    11  CA    11.863027   26.071810   45.980008   511    10    12    21
    12  CA    11.946409   25.271053   47.132217   512    11    13    38
    13  CA    13.046159   24.408912   47.320215   513     8    12    37
    14  CT    12.886558   26.853695   43.717548   514    10    15    34    35
    15  CA    11.565451   27.227335   43.075931   515    14    16    20
    16  CA    11.366418   28.513984   42.543721   516    15    17    33
    17  CA    10.112259   28.877257   42.013711   517    16    18    29
    18  CA     9.066195   27.936458   41.974926   518    17    19    30
    19  CA     9.273854   26.635292   42.467250   519    18    20    31
    20  CA    10.520349   26.286914   43.015050   520    15    19    32
    21  OH    10.779640   26.895518   45.850436   521    11    39
    22  CT    15.474265   20.483484   45.817406   522     3    44    45    46
    23  OS    16.103438   19.424523   50.437324   523     5    24
    24  CT    16.425438   19.552502   51.820445   524    23    25    50    51
    25  C     17.426362   18.485080   52.251399   525    24    26    28
    26  O2    17.048019   17.488461   52.929292   526    25
    27  CT    15.459221   24.180787   49.420418   527     1    47    48    49
    28  O2    18.621180   18.602989   51.910129   528    25
    29  HA     9.950144   29.869411   41.615986   529    17
    30  HA     8.106845   28.209782   41.553404   530    18
    31  HA     8.482314   25.900854   42.420860   531    19
    32  HA    10.676577   25.282025   43.371747   532    20
    33  HA    12.171734   29.231760   42.554083   533    16
    34  HC    13.431393   26.302465   42.950849   534    14
    35  HC    13.494374   27.743377   43.872259   535    14
    36  HA    14.835907   25.196994   44.533508   536     9
    37  HA    13.062257   23.756189   48.179962   537    13
    38  HA    11.164456   25.298391   47.877163   538    12
    39  HO    10.830113   27.284551   44.980538   539    21
    40  HC    15.323622   22.930953   45.467235   540     7
    41  HC    16.176266   23.997396   46.497970   541     7
    42  HA    15.875650   18.983651   47.994214   542     4
    43  HA    15.761861   22.055913   50.971683   543     6
    44  HC    15.518980   19.396518   45.774934   544    22
    45  HC    14.536431   20.783067   45.348174   545    22
    46  HC    16.303493   20.873227   45.228004   546    22
    47  HC    16.211439   24.352868   50.188243   547    27
    48  HC    15.669688   24.887147   48.618907   548    27
    49  HC    14.489297   24.430381   49.850344   549    27
    50  HC    16.785960   20.543924   52.088802   550    24
    51  HC    15.507976   19.395070   52.388283   551    24