* LIGAND DATABASE FILE (OPLS2005)
*
001     113   114    203    306     599
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02089   105.32146   -30.16373
    3     1 S   H    _H1_     3     1.02077    65.74652    73.84450
    4     1 S   H    _H2_     4     1.02099    46.85633  -131.56270
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08611   110.43906    58.89593
   26    24 S   HC   HB22    34     1.08669   109.83319   178.93210
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CO   _C13    36     1.86062   101.09686   179.98022
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CT   _C14    37     1.55983   110.55733    79.97856
   38    37 S   HC   _H6_    38     1.09471   110.71615   -59.82487
   39    33 S   OH   _O36    52     1.43409   110.58254   -36.97236
   40    39 S   HO   _H22    53     0.97105   107.01067   -60.22359
   41    33 S   OS   _O33    54     1.44668   110.42733  -163.73569
   42    37 S   CT   _C15    39     1.54183   115.31228    67.10361
   43    42 S   HC   _H15    40     1.09540   109.51003   -46.29896
   44    42 S   HC   _H16    41     1.09768   110.21612    70.44747
   45    37 S   NP   _N8_    48     1.50630   107.29307  -172.58630
   46    45 S   H    _H19    49     1.01756   109.79109    25.67743
   47    45 S   H    _H20    50     1.01817   109.69052   -94.28683
   48    45 S   H    _H21    51     1.01735   109.75278   145.73500
   49    41 S   CA   _C11    55     1.36475   121.90050    60.54237
   50    42 S   CT   _C16    42     1.53070   113.50575  -166.82324
   51    50 S   HC   _H17    43     1.09661   109.35779    60.25784
   52    50 S   HC   _H18    44     1.09655   110.22940   -57.84974
   53    49 S   CA   _C10    56     1.38398   119.66668  -149.94610
   54    50 S   CO3  _C17    45     1.53370   114.95045  -178.48006
   55    54 S   O2Z  _O35    46     1.26535   114.02512   177.83174
   56    54 S   O2Z  _O34    47     1.26065   116.64945    -1.82037
   57    53 S   CA   _C9_    57     1.38695   115.37592   179.71676
   58    57 S   NB   _N6_    58     1.35182   123.18393     0.45628
   59    57 S   NI   _N4_    64     1.40337   121.32529  -178.42567
   60    58 S   CQ   _C12    59     1.34611   115.58290    -0.13417
   61    59 S   CD   _C8_    65     1.29616   117.88547    -3.44265
   62    61 S   HC   _H12    66     1.10334   117.75463   179.45824
   63    49 S   NB   _N5_    60     1.35000   116.18171    30.23320
   64    60 S   NE   _N7_    61     1.41117   116.54301   179.95577
   65    64 S   H    _H13    62     0.99888   119.19070    -3.23404
   66    64 S   H    _H14    63     0.99936   119.08009  -176.85297
   67    61 S   CT   _C7_    67     1.51146   125.82380    -1.35393
   68    67 S   HC   _H5_    68     1.09479   107.35375   127.76910
   69    53 S   NE   _N9_    69     1.37292   122.98238     0.34035
   70    69 S   H    _H23    70     1.01275   119.74555    -1.13038
   71    67 S   CT   _C6_    71     1.52307   109.21409  -114.00032
   72    71 S   HC   _H4_    72     1.09693   109.47207   159.98012
   73    71 S   CT   _C5_    73     1.53556   112.46616   -78.46828
   74    73 S   HC   _H3_    74     1.09568   109.24378    60.01207
   75    71 S   OS   _O37    96     1.42679   108.72189    42.82065
   76    73 S   CT   _C4_    75     1.52415   112.76613   -61.19970
   77    76 S   HC   _H9_    76     1.09356   111.21856   -58.57918
   78    76 S   HC   _H10    77     1.09518   111.51698    63.14036
   79    76 S   HC   _H11    78     1.09563   110.14594  -178.95657
   80    73 S   OS   _O41    79     1.42556   110.27724   177.39113
   81    75 S   CO4  _C18    97     1.36757   115.74400   148.40728
   82    81 S   O    _O38    98     1.22499   125.52164    -0.03426
   83    80 S   CO4  _C23    80     1.36505   115.93092  -148.77939
   84    83 S   O    _O42    81     1.22636   125.03209     0.03426
   85    81 S   CT1  _C19    99     1.51375   109.77492  -179.12598
   86    85 S   HC   _H7_   100     1.09557   108.11329   -60.86140
   87    83 S   CT1  _C24    82     1.52258   112.28723   179.93744
   88    87 S   HC   _H8_    83     1.09630   106.30619   -59.94182
   89    85 S   CTJ  _C20   101     1.53268   113.18669    61.62770
   90    89 S   HC   _H24   102     1.09737   108.95737  -179.97202
   91    89 S   HC   _H25   103     1.09872   108.85140   -64.89264
   92    85 S   NP   _N10   110     1.49117   110.40406  -175.36477
   93    92 S   H    _H28   111     1.02291   110.53756  -160.78598
   94    92 S   H    _H29   112     1.02222   110.56569    79.20708
   95    92 S   H    _H30   113     1.02279   110.55455   -40.84558
   96    87 S   CTJ  _C25    84     1.53289   111.69952    59.23122
   97    96 S   HC   _H31    85     1.09802   109.20565   179.93147
   98    96 S   HC   _H32    86     1.09809   108.90921   -64.13664
   99    87 S   NT   _N11    93     1.44113   112.53911  -175.02397
  100    99 S   H    _H35    94     1.00683   119.07301  -161.13420
  101    99 S   H    _H36    95     1.00610   119.04821    32.23728
  102    89 S   CTI  _C21   104     1.52943   114.81458    57.59374
  103   102 S   HC   _H26   105     1.09602   110.11951   -56.74020
  104   102 S   HC   _H27   106     1.09671   109.78177    61.36832
  105    96 S   CTI  _C26    87     1.53059   114.00472    57.76885
  106   105 S   HC   _H33    88     1.09666   109.80744   -56.68766
  107   105 S   HC   _H34    89     1.09590   109.87893    61.22409
  108   102 S   CO3  _C22   107     1.53311   115.01953  -177.62562
  109   108 S   O2Z  _O40   108     1.26174   116.71533  -177.46063
  110   108 S   O2Z  _O39   109     1.26511   114.02442     2.46371
  111   105 S   CO3  _C27    90     1.53303   115.03585  -177.66385
  112   111 S   O2Z  _O44    91     1.26147   116.69187  -177.54808
  113   111 S   O2Z  _O43    92     1.26496   114.02281     2.37405
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  16   2   1   1  16  10   5   1   8  12   6   5   4   2   1   1
  10   5   4   3  11   2   1   1  10   8   7   4   9   4   4   2
   1   1  11   6   5   1  13   6  11   7   8   5   3   2   1   6
  11   4  10   4  12   8  11   7  12   6   5   4   2   1   1  11
   6   5   3   1   1   5   4   3   5   4   3   2   1   1   2   1
   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    41    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    45    39    40    41    49  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    44    50    45    46    47    48    39    40    41    49    53    63  
   35    36  
   36  
    0  
   38    42    43    44    50    51    52    54    45    46    47    48    39    40    41    49  
   42    43    44    50    45    46    47    48    39    41  
   40    41    49    42    45  
   41  
   49    53    57    60    63    69    42    45  
   43    44    50    51    52    54    55    56    45    46    47    48  
   44    50    51    52    54    45  
   50    51    52    54    45  
   46    47    48    50  
   47    48  
   48  
    0  
   53    57    58    60    63    64    59    67    69    70  
   51    52    54    55    56  
   52    54    55    56  
   54    55    56  
   57    58    60    63    59    61    67    68    69    70    71  
   55    56  
   56  
    0  
   58    60    63    64    59    61    62    67    69    70  
   60    63    64    65    66    59    61    69  
   61    62    67    68    69    71    60  
   63    64    65    66  
   62    67    68    69    70    71    72    73    75  
   67    68    69    71  
   64    65    66    69  
   65    66  
   66  
    0  
   68    69    70    71    72    73    74    76    80    75    81  
   69    70    71    72    73    75  
   70    71    72    73    75  
   71  
   72    73    74    76    77    78    79    80    83    75    81    82    85  
   73    74    76    80    75    81  
   74    76    77    78    79    80    83    84    87    75    81  
   76    77    78    79    80    83    75  
   81    82    85    86    89    92    76    80  
   77    78    79    80    83  
   78    79    80  
   79    80  
   80  
   83    84    87    88    96    99  
   82    85    86    89    90    91   102    92    93    94    95  
   85    86    89    92  
   84    87    88    96    97    98   105    99   100   101  
   87    88    96    99  
   86    89    90    91   102   103   104   108    92    93    94    95  
   89    90    91   102    92    93    94    95  
   88    96    97    98   105   106   107   111    99   100   101  
   96    97    98   105    99   100   101  
   90    91   102   103   104   108   109   110    92    93    94    95  
   91   102   103   104   108    92  
  102   103   104   108    92  
   93    94    95   102  
   94    95  
   95  
    0  
   97    98   105   106   107   111   112   113    99   100   101  
   98   105   106   107   111    99  
  105   106   107   111    99  
  100   101   105  
  101  
    0  
  103   104   108   109   110  
  104   108   109   110  
  108   109   110  
  106   107   111   112   113  
  107   111   112   113  
  111   112   113  
  109   110  
  110  
    0  
  112   113  
  113  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.372200   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   39   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   40   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   41   2.9000   0.1400  -0.300000   1.7660   1.5600   0.020110767  -0.896042159
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   45   3.2500   0.1700  -0.300000   2.1950   1.9500   0.003973653   1.685851020
   46   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   47   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   48   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5500   0.0700   0.764000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   53   3.5500   0.0700  -0.292000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   57   3.5500   0.0700   0.694800   2.5000   1.7750   0.001000000  -0.843144165
   58   3.2500   0.1700  -0.839000   1.8000   1.6000   0.001000000  -0.511443539
   59   3.2800   0.1700  -0.420500   1.8540   1.6400   0.005000000   0.000000000
   60   3.5500   0.0700   1.042000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.7500   0.1050   0.313400   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.040200   1.4250   1.2500   0.008598240   0.268726247
   63   3.2500   0.1700  -0.839000   1.8000   1.6000   0.001000000  -0.511443539
   64   3.3000   0.1700  -0.920000   1.8650   1.6500   0.051222218  -2.220205820
   65   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   66   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   67   3.5000   0.0660   0.176100   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.3000   0.1700  -0.780000   1.8650   1.6500   0.051222218  -2.220205820
   70   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   73   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   75   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   76   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   81   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   82   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   83   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   84   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   85   3.5000   0.0660   0.250000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   87   3.5000   0.0660   0.163900   1.9750   1.7500   0.005000000  -0.741685710
   88   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   90   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   91   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   92   3.2500   0.1700  -0.300000   2.2900   2.0360   0.003973653   1.685851020
   93   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   94   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   95   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   96   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
  100   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
  101   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
  102   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  105   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
  106   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  108   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
  109   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  110   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  111   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
  112   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
  113   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   250.000  1.527
   33    39   380.000  1.407
   33    41   320.000  1.380
   37    38   340.000  1.090
   37    42   268.000  1.529
   37    45   367.000  1.471
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    54   317.000  1.522
   54    55   656.000  1.250
   54    56   656.000  1.250
   45    46   434.000  1.010
   45    47   434.000  1.010
   45    48   434.000  1.010
   39    40   553.000  0.945
   41    49   450.000  1.364
   49    53   469.000  1.400
   49    63   483.000  1.339
   53    57   469.000  1.400
   53    69   481.000  1.340
   57    58   483.000  1.339
   57    59   400.000  1.385
   58    60   502.000  1.324
   60    63   502.000  1.324
   60    64   410.000  1.375
   64    65   434.000  1.010
   64    66   434.000  1.010
   59    61   500.000  1.261
   61    62   370.000  1.093
   61    67   270.000  1.508
   67    68   340.000  1.090
   67    69   382.000  1.448
   67    71   268.000  1.529
   69    70   434.000  1.010
   71    72   340.000  1.090
   71    73   268.000  1.529
   71    75   320.000  1.410
   73    74   340.000  1.090
   73    76   268.000  1.529
   73    80   320.000  1.410
   76    77   340.000  1.090
   76    78   340.000  1.090
   76    79   340.000  1.090
   80    83   214.000  1.327
   83    84   570.000  1.229
   83    87   255.000  1.522
   87    88   340.000  1.090
   87    96   268.000  1.529
   87    99   305.000  1.457
   96    97   340.000  1.090
   96    98   340.000  1.090
   96   105   268.000  1.529
  105   106   340.000  1.090
  105   107   340.000  1.090
  105   111   317.000  1.522
  111   112   656.000  1.250
  111   113   656.000  1.250
   99   100   434.000  1.010
   99   101   434.000  1.010
   75    81   214.000  1.327
   81    82   570.000  1.229
   81    85   255.000  1.522
   85    86   340.000  1.090
   85    89   268.000  1.529
   85    92   367.000  1.471
   89    90   340.000  1.090
   89    91   340.000  1.090
   89   102   268.000  1.529
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   108   317.000  1.522
  108   109   656.000  1.250
  108   110   656.000  1.250
   92    93   434.000  1.010
   92    94   434.000  1.010
   92    95   434.000  1.010
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    39    85.00000  114.68000
   29    33    41    85.00000  114.68000
   33    37    38    45.00000  108.72000
   33    37    42    75.00000  109.43000
   33    37    45    80.00000  111.20000
   33    39    40    70.00000  107.92000
   33    41    49   100.00000  112.36700
   37    42    43    37.50000  110.70000
   37    42    44    37.50000  110.70000
   37    42    50    58.35000  112.70000
   37    45    46    35.00000  109.50000
   37    45    47    35.00000  109.50000
   37    45    48    35.00000  109.50000
   42    37    38    37.50000  110.70000
   42    50    51    37.50000  110.70000
   42    50    52    37.50000  110.70000
   42    50    54    70.00000  109.69300
   44    42    43    33.00000  107.80000
   50    42    43    37.50000  110.70000
   50    42    44    37.50000  110.70000
   50    54    55    70.00000  117.00000
   50    54    56    70.00000  117.00000
   52    50    51    33.00000  107.80000
   54    50    51    35.00000  109.50000
   54    50    52    35.00000  109.50000
   56    54    55    80.00000  126.00000
   45    37    38    35.00000  109.50000
   45    37    42    80.00000  111.20000
   47    45    46    35.00000  109.50000
   48    45    46    35.00000  109.50000
   48    45    47    35.00000  109.50000
   39    33    37    90.00000  110.19100
   41    33    37    90.00000  108.56700
   41    33    39   110.00000  112.08000
   41    49    53    70.00000  120.00000
   41    49    63    95.00000  115.10700
   49    53    57    63.00000  120.00000
   49    53    69    70.00000  120.10000
   49    63    60    70.00000  118.60000
   53    57    58    70.00000  124.00000
   53    57    59    70.00000  120.44500
   53    69    67    50.00000  120.00000
   53    69    70    35.00000  113.50000
   57    58    60    70.00000  118.60000
   57    59    61    70.00000  113.96500
   58    60    63    70.00000  129.10000
   58    60    64    85.00000  116.09700
   60    64    65    50.00000  113.31100
   60    64    66    50.00000  113.31100
   63    49    53    70.00000  124.00000
   64    60    63    85.00000  116.09700
   66    64    65    35.00000  109.00000
   59    57    58    75.00000  118.65000
   59    61    62    45.00000  120.55300
   59    61    67    65.00000  122.10100
   61    67    68    45.00000  109.49600
   61    67    69    80.00000  112.42400
   61    67    71    70.00000  111.76100
   67    61    62    40.00000  113.58700
   67    69    70    35.00000  112.50000
   67    71    72    37.50000  110.70000
   67    71    73    58.35000  112.70000
   67    71    75    50.00000  109.50000
   69    53    57    70.00000  120.10000
   69    67    68    35.00000  109.50000
   71    67    68    37.50000  110.70000
   71    67    69    80.00000  111.61500
   71    73    74    37.50000  110.70000
   71    73    76    58.35000  112.70000
   71    73    80    50.00000  109.50000
   71    75    81    83.00000  116.90000
   73    71    72    37.50000  110.70000
   73    76    77    37.50000  110.70000
   73    76    78    37.50000  110.70000
   73    76    79    37.50000  110.70000
   73    80    83    83.00000  116.90000
   76    73    74    37.50000  110.70000
   78    76    77    33.00000  107.80000
   79    76    77    33.00000  107.80000
   79    76    78    33.00000  107.80000
   80    73    74    35.00000  109.50000
   80    73    76    50.00000  109.50000
   80    83    84    83.00000  123.40000
   80    83    87    90.00000  109.72300
   83    87    88    45.00000  110.09800
   83    87    96    65.00000  117.82000
   83    87    99    75.00000  112.91400
   87    83    84    75.00000  123.42600
   87    96    97    37.50000  110.70000
   87    96    98    37.50000  110.70000
   87    96   105    58.35000  112.70000
   87    99   100    50.00000  111.55300
   87    99   101    50.00000  111.55300
   96    87    88    37.50000  110.70000
   96   105   106    37.50000  110.70000
   96   105   107    37.50000  110.70000
   96   105   111    63.00000  111.10000
   98    96    97    33.00000  107.80000
  105    96    97    37.50000  110.70000
  105    96    98    37.50000  110.70000
  105   111   112    70.00000  117.00000
  105   111   113    70.00000  117.00000
  107   105   106    33.00000  107.80000
  111   105   106    35.00000  109.50000
  111   105   107    35.00000  109.50000
  113   111   112    80.00000  126.00000
   99    87    88    50.00000  109.55000
   99    87    96    80.00000  111.22000
  101    99   100    43.60000  106.40000
   75    71    72    35.00000  109.50000
   75    71    73    50.00000  109.50000
   75    81    82    83.00000  123.40000
   75    81    85    90.00000  109.72300
   81    85    86    45.00000  110.09800
   81    85    89    65.00000  117.82000
   81    85    92    85.00000  107.27000
   85    81    82    75.00000  123.42600
   85    89    90    37.50000  110.70000
   85    89    91    37.50000  110.70000
   85    89   102    58.35000  112.70000
   85    92    93    35.00000  109.50000
   85    92    94    35.00000  109.50000
   85    92    95    35.00000  109.50000
   89    85    86    37.50000  110.70000
   89   102   103    37.50000  110.70000
   89   102   104    37.50000  110.70000
   89   102   108    63.00000  111.10000
   91    89    90    33.00000  107.80000
  102    89    90    37.50000  110.70000
  102    89    91    37.50000  110.70000
  102   108   109    70.00000  117.00000
  102   108   110    70.00000  117.00000
  104   102   103    33.00000  107.80000
  108   102   103    35.00000  109.50000
  108   102   104    35.00000  109.50000
  110   108   109    80.00000  126.00000
   92    85    86    35.00000  109.50000
   92    85    89    80.00000  111.20000
   94    92    93    35.00000  109.50000
   95    92    93    35.00000  109.50000
   95    92    94    35.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  1.0 3.0
   24    29    33    41   0.13850  1.0 1.0
   24    29    33    41  -1.34450 -1.0 2.0
   24    29    33    41   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    42   0.44750  1.0 1.0
   29    33    37    42  -0.17800 -1.0 2.0
   29    33    37    42   0.20200  1.0 3.0
   29    33    37    45   0.56750  1.0 1.0
   29    33    37    45  -0.07550 -1.0 2.0
   29    33    37    45   0.20000  1.0 3.0
   29    33    39    40   0.35600  1.0 1.0
   29    33    39    40  -0.10750 -1.0 2.0
   29    33    39    40  -0.54400  1.0 3.0
   29    33    41    49   0.14700  1.0 1.0
   29    33    41    49  -1.16150 -1.0 2.0
   29    33    41    49   0.48700  1.0 3.0
   33    37    42    43   0.15000  1.0 3.0
   33    37    42    44   0.15000  1.0 3.0
   33    37    42    50   3.97050  1.0 1.0
   33    37    45    46   0.17350  1.0 3.0
   33    37    45    47   0.17350  1.0 3.0
   33    37    45    48   0.17350  1.0 3.0
   33    41    49    53   1.63200 -1.0 2.0
   33    41    49    63  -0.24600  1.0 1.0
   33    41    49    63   2.11300 -1.0 2.0
   37    33    39    40  -0.11600  1.0 1.0
   37    33    39    40  -0.09450 -1.0 2.0
   37    33    39    40   0.21250  1.0 3.0
   37    33    41    49  -0.32850  1.0 1.0
   37    33    41    49  -0.35800 -1.0 2.0
   37    33    41    49   0.33950  1.0 3.0
   37    42    50    51   0.15000  1.0 3.0
   37    42    50    52   0.15000  1.0 3.0
   37    42    50    54  -1.63150  1.0 1.0
   37    42    50    54  -0.43550 -1.0 2.0
   37    42    50    54   0.24500  1.0 3.0
   38    37    42    43   0.15000  1.0 3.0
   38    37    42    44   0.15000  1.0 3.0
   38    37    42    50   0.15000  1.0 3.0
   38    37    45    46   0.13050  1.0 3.0
   38    37    45    47   0.13050  1.0 3.0
   38    37    45    48   0.13050  1.0 3.0
   42    37    45    46   0.17350  1.0 3.0
   42    37    45    47   0.17350  1.0 3.0
   42    37    45    48   0.17350  1.0 3.0
   42    50    54    55   0.41150 -1.0 2.0
   42    50    54    56   0.41150 -1.0 2.0
   43    42    50    51   0.15000  1.0 3.0
   43    42    50    52   0.15000  1.0 3.0
   43    42    50    54  -0.11250  1.0 3.0
   44    42    50    51   0.15000  1.0 3.0
   44    42    50    52   0.15000  1.0 3.0
   44    42    50    54  -0.11250  1.0 3.0
   51    50    54    55   0.00000  1.0 1.0
   51    50    54    56   0.00000  1.0 1.0
   52    50    54    55   0.00000  1.0 1.0
   52    50    54    56   0.00000  1.0 1.0
   45    37    42    43   0.19200  1.0 3.0
   45    37    42    44   0.19200  1.0 3.0
   45    37    42    50   1.36600  1.0 1.0
   45    37    42    50  -0.11450 -1.0 2.0
   45    37    42    50   0.24250  1.0 3.0
   39    33    37    38   0.23400  1.0 3.0
   39    33    37    42   0.86500  1.0 1.0
   39    33    37    42  -0.17500 -1.0 2.0
   39    33    37    42   0.20800  1.0 3.0
   39    33    37    45   1.69300  1.0 1.0
   39    33    37    45  -0.48450 -1.0 2.0
   39    33    41    49  -0.25600  1.0 1.0
   39    33    41    49  -0.40050 -1.0 2.0
   39    33    41    49   0.34700  1.0 3.0
   41    33    37    38   0.23400  1.0 3.0
   41    33    37    42   0.62750  1.0 1.0
   41    33    37    42  -0.30950 -1.0 2.0
   41    33    37    42   0.27300  1.0 3.0
   41    33    37    45   1.69300  1.0 1.0
   41    33    37    45  -0.48450 -1.0 2.0
   41    33    39    40  -0.50000  1.0 1.0
   41    33    39    40  -0.73950 -1.0 2.0
   41    33    39    40   0.17150  1.0 3.0
   41    49    53    57   3.62500 -1.0 2.0
   41    49    53    69   3.62500 -1.0 2.0
   41    49    63    60   3.62500 -1.0 2.0
   49    53    57    58   3.62500 -1.0 2.0
   49    53    57    59   3.62500 -1.0 2.0
   49    53    69    67  -1.00000  1.0 1.0
   49    53    69    67   1.25000 -1.0 2.0
   49    53    69    70   1.00000 -1.0 2.0
   53    49    63    60   3.62500 -1.0 2.0
   53    57   -58    60   3.62500 -1.0 2.0
   53    57    59    61   1.25000 -1.0 2.0
   57    53    69    67  -1.00000  1.0 1.0
   57    53    69    67   1.25000 -1.0 2.0
   57    53    69    70   1.00000 -1.0 2.0
   57    58    60    63   3.62500 -1.0 2.0
   57    58    60    64   3.62500 -1.0 2.0
   57    59    61    62   4.00000 -1.0 2.0
   57    59   -61    67   6.00000 -1.0 2.0
   58    57    59    61   1.25000 -1.0 2.0
   58    60   -63    49   3.62500 -1.0 2.0
   58    60    64    65   1.75000 -1.0 2.0
   58    60    64    66   1.75000 -1.0 2.0
   63    49   -53    57   3.62500 -1.0 2.0
   63    49    53    69   3.62500 -1.0 2.0
   63    60    64    65   1.75000 -1.0 2.0
   63    60    64    66   1.75000 -1.0 2.0
   64    60    63    49   3.62500 -1.0 2.0
   59    57    58    60   3.62500 -1.0 2.0
   59    61    67    68   0.00000  1.0 1.0
   59    61    67    69   0.00000  1.0 1.0
   59    61    67    71   0.00000  1.0 1.0
   61    67   -69    53  -0.12500  1.0 1.0
   61    67   -69    53  -0.12500 -1.0 2.0
   61    67   -69    53   0.25000  1.0 3.0
   61    67    69    70  -0.12500  1.0 1.0
   61    67    69    70  -0.12500 -1.0 2.0
   61    67    69    70   0.25000  1.0 3.0
   61    67    71    72   0.15000  1.0 3.0
   61    67    71    73   0.34400  1.0 1.0
   61    67    71    73   0.09450 -1.0 2.0
   61    67    71    73   0.11100  1.0 3.0
   61    67    71    75   0.61850  1.0 1.0
   61    67    71    75  -0.22750 -1.0 2.0
   61    67    71    75   0.15300  1.0 3.0
   62    61    67    68   0.00000  1.0 1.0
   62    61    67    69   0.00000  1.0 1.0
   62    61    67    71   0.00000  1.0 1.0
   67    71    73    74   0.15000  1.0 3.0
   67    71    73    76   0.56750  1.0 1.0
   67    71    73    76  -0.07550 -1.0 2.0
   67    71    73    76   0.20000  1.0 3.0
   67    71    73    80   0.62750  1.0 1.0
   67    71    73    80  -0.30950 -1.0 2.0
   67    71    73    80   0.27300  1.0 3.0
   67    71    75    81  -0.25900  1.0 1.0
   67    71    75    81  -0.47000 -1.0 2.0
   67    71    75    81   0.11750  1.0 3.0
   68    67    69    53   0.00000  1.0 1.0
   68    67    69    70   0.00000  1.0 1.0
   68    67    71    72   0.15000  1.0 3.0
   68    67    71    73   0.15000  1.0 3.0
   68    67    71    75   0.23400  1.0 3.0
   69    53    57    58   3.62500 -1.0 2.0
   69    53   -57    59   3.62500 -1.0 2.0
   69    67    71    72   0.22950  1.0 3.0
   69    67    71    73   1.26750  1.0 1.0
   69    67    71    73  -0.00950 -1.0 2.0
   69    67    71    73   0.30600  1.0 3.0
   69    67    71    75   2.03850  1.0 1.0
   69    67    71    75  -0.40600 -1.0 2.0
   71    67    69    53  -0.12500  1.0 1.0
   71    67    69    53  -0.12500 -1.0 2.0
   71    67    69    53   0.25000  1.0 3.0
   71    67    69    70   0.00000  1.0 1.0
   71    73    76    77   0.15000  1.0 3.0
   71    73    76    78   0.15000  1.0 3.0
   71    73    76    79   0.15000  1.0 3.0
   71    73    80    83  -0.25900  1.0 1.0
   71    73    80    83  -0.47000 -1.0 2.0
   71    73    80    83   0.11750  1.0 3.0
   71    75    81    82   3.00000 -1.0 2.0
   71    75    81    85   1.63150  1.0 1.0
   71    75    81    85   2.92000 -1.0 2.0
   72    71    73    74   0.15000  1.0 3.0
   72    71    73    76   0.15000  1.0 3.0
   72    71    73    80   0.23400  1.0 3.0
   72    71    75    81   0.08050  1.0 3.0
   73    71    75    81  -0.25900  1.0 1.0
   73    71    75    81  -0.47000 -1.0 2.0
   73    71    75    81   0.11750  1.0 3.0
   73    80    83    84   3.00000 -1.0 2.0
   73    80    83    87   1.63150  1.0 1.0
   73    80    83    87   2.92000 -1.0 2.0
   74    73    76    77   0.15000  1.0 3.0
   74    73    76    78   0.15000  1.0 3.0
   74    73    76    79   0.15000  1.0 3.0
   74    73    80    83   0.08050  1.0 3.0
   76    73    80    83  -0.25900  1.0 1.0
   76    73    80    83  -0.47000 -1.0 2.0
   76    73    80    83   0.11750  1.0 3.0
   80    73    76    77   0.23400  1.0 3.0
   80    73    76    78   0.23400  1.0 3.0
   80    73    76    79   0.23400  1.0 3.0
   80    83    87    88   0.00000  1.0 1.0
   80    83    87    96   0.36750  1.0 3.0
   80    83    87    99   0.40000  1.0 3.0
   83    87    96    97  -0.03800  1.0 3.0
   83    87    96    98  -0.03800  1.0 3.0
   83    87    96   105  -0.76350  1.0 1.0
   83    87    96   105   1.70300 -1.0 2.0
   83    87    99   100   0.21900  1.0 1.0
   83    87    99   100  -0.24900 -1.0 2.0
   83    87    99   100   0.15200  1.0 3.0
   83    87    99   101   0.21900  1.0 1.0
   83    87    99   101  -0.24900 -1.0 2.0
   83    87    99   101   0.15200  1.0 3.0
   84    83    87    88   0.00000  1.0 1.0
   84    83    87    96   0.00000  1.0 1.0
   84    83    87    99   0.30150 -1.0 2.0
   87    96   105   106   0.15000  1.0 3.0
   87    96   105   107   0.15000  1.0 3.0
   87    96   105   111  -1.59250  1.0 1.0
   87    96   105   111  -0.41250 -1.0 2.0
   87    96   105   111   0.24650  1.0 3.0
   88    87    96    97   0.15000  1.0 3.0
   88    87    96    98   0.15000  1.0 3.0
   88    87    96   105   0.15000  1.0 3.0
   88    87    99   100   0.20000  1.0 3.0
   88    87    99   101   0.20000  1.0 3.0
   96    87    99   100  -0.05950  1.0 1.0
   96    87    99   100   0.08850 -1.0 2.0
   96    87    99   100   0.11750  1.0 3.0
   96    87    99   101  -0.05950  1.0 1.0
   96    87    99   101   0.08850 -1.0 2.0
   96    87    99   101   0.11750  1.0 3.0
   96   105   111   112   0.27300 -1.0 2.0
   96   105   111   113   0.27300 -1.0 2.0
   97    96   105   106   0.15000  1.0 3.0
   97    96   105   107   0.15000  1.0 3.0
   97    96   105   111  -0.11250  1.0 3.0
   98    96   105   106   0.15000  1.0 3.0
   98    96   105   107   0.15000  1.0 3.0
   98    96   105   111  -0.11250  1.0 3.0
  106   105   111   112   0.00000  1.0 1.0
  106   105   111   113   0.00000  1.0 1.0
  107   105   111   112   0.00000  1.0 1.0
  107   105   111   113   0.00000  1.0 1.0
   99    87    96    97   0.15000  1.0 3.0
   99    87    96    98   0.15000  1.0 3.0
   99    87    96   105   1.53400  1.0 1.0
   99    87    96   105  -0.09950 -1.0 2.0
   99    87    96   105   0.05700  1.0 3.0
   75    71    73    74   0.23400  1.0 3.0
   75    71    73    76   0.62750  1.0 1.0
   75    71    73    76  -0.30950 -1.0 2.0
   75    71    73    76   0.27300  1.0 3.0
   75    71    73    80   1.11900  1.0 1.0
   75    71    73    80  -1.16350 -1.0 2.0
   75    71    73    80  -0.34150  1.0 3.0
   75    81    85    86   0.00000  1.0 1.0
   75    81    85    89   0.36750  1.0 3.0
   75    81    85    92   0.40000  1.0 3.0
   81    85    89    90  -0.03800  1.0 3.0
   81    85    89    91  -0.03800  1.0 3.0
   81    85    89   102  -0.76350  1.0 1.0
   81    85    89   102   1.70300 -1.0 2.0
   81    85    92    93   0.17350  1.0 3.0
   81    85    92    94   0.17350  1.0 3.0
   81    85    92    95   0.17350  1.0 3.0
   82    81    85    86   0.00000  1.0 1.0
   82    81    85    89   0.00000  1.0 1.0
   82    81    85    92   0.00000  1.0 1.0
   85    89   102   103   0.15000  1.0 3.0
   85    89   102   104   0.15000  1.0 3.0
   85    89   102   108  -1.59250  1.0 1.0
   85    89   102   108  -0.41250 -1.0 2.0
   85    89   102   108   0.24650  1.0 3.0
   86    85    89    90   0.15000  1.0 3.0
   86    85    89    91   0.15000  1.0 3.0
   86    85    89   102   0.15000  1.0 3.0
   86    85    92    93   0.13050  1.0 3.0
   86    85    92    94   0.13050  1.0 3.0
   86    85    92    95   0.13050  1.0 3.0
   89    85    92    93   0.17350  1.0 3.0
   89    85    92    94   0.17350  1.0 3.0
   89    85    92    95   0.17350  1.0 3.0
   89   102   108   109   0.27300 -1.0 2.0
   89   102   108   110   0.27300 -1.0 2.0
   90    89   102   103   0.15000  1.0 3.0
   90    89   102   104   0.15000  1.0 3.0
   90    89   102   108  -0.11250  1.0 3.0
   91    89   102   103   0.15000  1.0 3.0
   91    89   102   104   0.15000  1.0 3.0
   91    89   102   108  -0.11250  1.0 3.0
  103   102   108   109   0.00000  1.0 1.0
  103   102   108   110   0.00000  1.0 1.0
  104   102   108   109   0.00000  1.0 1.0
  104   102   108   110   0.00000  1.0 1.0
   92    85    89    90   0.23200  1.0 3.0
   92    85    89    91   0.23200  1.0 3.0
   92    85    89   102   1.79450  1.0 1.0
   92    85    89   102   1.06000 -1.0 2.0
   92    85    89   102  -0.53000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   55    50    54    56  10.50000 -1.0 2.0
   53    63    49    41   4.00000 -1.0 2.0
   57    69    53    49   4.00000 -1.0 2.0
   58    59    57    53   4.00000 -1.0 2.0
   63    64    60    58   4.00000 -1.0 2.0
   66    60    64    65   1.00000 -1.0 2.0
   67    62    61    59  10.50000 -1.0 2.0
   70    53    69    67   1.00000 -1.0 2.0
   80    87    83    84  10.50000 -1.0 2.0
  112   105   111   113  10.50000 -1.0 2.0
   75    85    81    82  10.50000 -1.0 2.0
  109   102   108   110  10.50000 -1.0 2.0
END
