* LIGAND DATABASE FILE (OPLS2005)
*
001      74    76    131    205     378
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02143    40.18977  -147.41623
    3     1 S   H    _H1_     3     1.02092   102.27684   -42.86974
    4     1 S   H    _H2_     4     1.02040    73.80842    63.30056
    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     1.04690   118.93088     8.54895
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08448   106.42696   -11.15906
   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     1.08733   110.25787    59.09629
   26    24 S   HC   HB22    34     1.08755   109.66015   178.71915
   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   CT   _C20    36     1.80889    98.46174   180.00000
   34    33 S   F    F1__    37     1.35992   110.15738   158.49942
   35    33 S   F    F2__    38     1.35898   110.17391    41.54872
   36    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   37    36 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   38    36 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   39    33 S   C5BB _C13    39     1.48492   109.37770   -80.03852
   40    39 S   C5BD _C12    40     1.33757   127.32112   118.62306
   41    40 S   HA   _H10    41     1.07669   127.91926     0.29608
   42    40 S   C5A  _C11    42     1.43906   106.03029  -179.28536
   43    42 S   CA   _C8_    43     1.46010   126.72667   166.88083
   44    42 S   NA   _N5_    57     1.42073   105.90022    -0.97136
   45    43 S   CA   _C7_    44     1.39401   119.99341    59.97517
   46    45 S   HA   _H7_    45     1.08759   120.83895     0.04423
   47    44 S   CA   _C14    58     1.41473   131.95965  -176.58958
   48    39 S   N5A  _N4_    74     1.37796   120.31110   -61.12747
   49    45 S   CA   _C6_    46     1.39483   120.01730  -179.96574
   50    49 S   HA   _H6_    47     1.08660   119.55481  -179.95154
   51    47 S   CA   _C15    59     1.39448   120.03587  -150.02794
   52    51 S   HA   _H11    60     1.08758   120.96283     0.05595
   53    49 S   CA   _C5_    48     1.39478   119.97116    -0.01978
   54    51 S   CA   _C16    61     1.39494   120.02054  -179.97202
   55    54 S   HA   _H12    62     1.08645   119.41492  -179.92598
   56    53 S   CA   _C10    49     1.39541   120.01295     0.00000
   57    56 S   HA   _H9_    50     1.08675   120.47043   179.96574
   58    53 S   CT   _C4_    53     1.49160   119.97704   179.95577
   59    58 S   HC   _H3_    54     1.09631   110.44591    89.98415
   60    58 S   HC   _H4_    55     1.09777   111.24802  -149.47974
   61    58 S   HC   _H5_    56     1.09860   111.25144   -30.56268
   62    54 S   CA   _C17    63     1.39500   119.95650     0.00000
   63    43 S   CA   _C9_    51     1.39478   119.99512  -120.00847
   64    63 S   HA   _H8_    52     1.08729   120.83992     0.06256
   65    62 S   CA   _C18    64     1.39435   120.05475     0.04423
   66    65 S   HA   _H13    65     1.08668   120.67413   180.00000
   67    62 S   SY   _S1_    68     1.74654   119.96115   179.92867
   68    67 S   OY   _O33    69     1.45591   108.37563  -155.71227
   69    67 S   OY   _O34    70     1.45596   108.50370   -24.14135
   70    47 S   CA   _C19    66     1.39560   119.96178    30.05253
   71    70 S   HA   _H14    67     1.08786   120.91043    -0.01978
   72    67 S   NS   _N6_    71     1.70825   100.98397    90.04001
   73    72 S   H    _H15    72     1.02728   117.99954   108.39940
   74    72 S   H    _H16    73     1.02751   118.02641  -108.39995
  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   6   5   4   3
   8   4   3   2   1   1   7   8   4  12  12  10   8   4  10   2
   9   3   8   4   8   9   3   7   3   4   2   1   1  10   1   1
   7   3   6   4   3   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    48  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    44    48  
   35    39    40    48  
   39    40    48  
   37    38  
   38  
    0  
   40    41    42    43    44    47    48  
   41    42    43    45    63    44    47    48  
   42    43    44    48  
   43    45    46    49    56    63    64    44    47    51    70    48  
   45    46    49    50    53    56    57    63    64    44    47    48  
   47    51    52    54    65    70    71    48    45    63  
   46    49    50    53    56    63    64    58  
   49    50    53    63  
   51    52    54    55    62    65    66    70    71    48  
   51    70  
   50    53    56    57    63    58    59    60    61  
   53    56    58  
   52    54    55    62    65    70    71    67  
   54    55    62    70  
   56    57    63    64    58    59    60    61  
   55    62    65    66    70    67    68    69    72  
   62    65    67  
   57    63    64    58    59    60    61  
   63    64    58  
   59    60    61    63  
   60    61  
   61  
    0  
   65    66    70    71    67    68    69    72    73    74  
   64  
    0  
   66    70    71    67    68    69    72  
   70    71    67  
   68    69    72    73    74    70  
   69    72    73    74  
   72    73    74  
   71  
    0  
   73    74  
   74  
    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   3.2500   0.0620   0.362500   2.4950   1.7500   0.005000000  -0.741685710
   34   2.9500   0.0530  -0.120000   2.4980   2.2250   0.001000000   0.985400000
   35   2.9500   0.0530  -0.120000   2.4980   2.2250   0.001000000   0.985400000
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0700   0.223000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700  -0.320000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.150000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5500   0.0700   0.108100   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5500   0.0700   0.062900   2.5000   1.7750   0.001000000  -0.843144165
   44   3.2500   0.1700   0.118900   1.8650   1.6500   0.001000000  -0.511443539
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5500   0.0700   0.073100   2.0020   1.7750   0.001000000  -0.843144165
   48   3.2500   0.1700  -0.531000   1.8650   1.6500   0.001000000  -0.511443539
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700   0.156700   2.5000   1.7750   0.001000000  -0.843144165
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5500   0.2500   0.832700   2.0020   1.7750   0.025682759  -1.666211680
   68   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   69   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   70   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   72   3.2500   0.1700  -0.767800   1.8100   1.6000   0.054801302  -1.445846770
   73   0.5000   0.0300   0.357200   0.9960   0.8600   0.030040813  -0.651083722
   74   0.5000   0.0300   0.357200   0.9960   0.8600   0.030040813  -0.651083722
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    34   367.000  1.332
   33    35   367.000  1.332
   33    39   295.000  1.498
   39    40   469.000  1.421
   39    48   410.000  1.320
   40    41   367.000  1.080
   40    42   546.000  1.367
   42    43   365.000  1.450
   42    44   427.000  1.381
   43    45   469.000  1.400
   43    63   469.000  1.400
   45    46   367.000  1.080
   45    49   469.000  1.400
   49    50   367.000  1.080
   49    53   469.000  1.400
   53    56   469.000  1.400
   53    58   317.000  1.510
   56    57   367.000  1.080
   56    63   469.000  1.400
   63    64   367.000  1.080
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   44    47   370.000  1.401
   44    48   400.000  1.349
   47    51   469.000  1.400
   47    70   469.000  1.400
   51    52   367.000  1.080
   51    54   469.000  1.400
   54    55   367.000  1.080
   54    62   469.000  1.400
   62    65   469.000  1.400
   62    67   225.000  1.779
   65    66   367.000  1.080
   65    70   469.000  1.400
   70    71   367.000  1.080
   67    68   735.000  1.471
   67    69   735.000  1.471
   67    72   245.000  1.722
   72    73   500.000  1.020
   72    74   500.000  1.020
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    34    90.00000  110.13500
   29    33    35    90.00000  110.13500
   29    33    39    80.00000  109.48900
   33    39    40    55.00000  128.96000
   33    39    48    70.00000  120.00000
   35    33    34    77.00000  109.10000
   39    33    34    50.00000  109.50000
   39    33    35    50.00000  109.50000
   39    40    41    35.00000  128.20000
   39    40    42    70.00000  103.80000
   39    48    44    70.00000  104.10000
   40    42    43    55.00000  129.60000
   40    42    44    70.00000  109.00000
   42    40    41    35.00000  126.90000
   42    43    45    65.00000  121.65900
   42    43    63    65.00000  121.65900
   42    44    47    65.00000  127.04000
   42    44    48    56.00000  113.10000
   43    45    46    35.00000  120.00000
   43    45    49    63.00000  120.00000
   43    63    56    63.00000  120.00000
   43    63    64    35.00000  120.00000
   45    49    50    35.00000  120.00000
   45    49    53    63.00000  120.00000
   49    45    46    35.00000  120.00000
   49    53    56    63.00000  120.00000
   49    53    58    70.00000  120.00000
   53    49    50    35.00000  120.00000
   53    56    57    35.00000  120.00000
   53    56    63    63.00000  120.00000
   53    58    59    35.00000  109.50000
   53    58    60    35.00000  109.50000
   53    58    61    35.00000  109.50000
   56    63    64    35.00000  120.00000
   63    43    45    63.00000  120.00000
   63    56    57    35.00000  120.00000
   58    53    56    70.00000  120.00000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   44    42    43    75.00000  120.22300
   44    47    51    70.00000  119.05500
   44    47    70    70.00000  119.05500
   47    51    52    35.00000  120.00000
   47    51    54    63.00000  120.00000
   47    70    65    63.00000  120.00000
   47    70    71    35.00000  120.00000
   51    54    55    35.00000  120.00000
   51    54    62    63.00000  120.00000
   54    51    52    35.00000  120.00000
   54    62    65    63.00000  120.00000
   54    62    67    65.00000  117.06700
   62    54    55    35.00000  120.00000
   62    65    66    35.00000  120.00000
   62    65    70    63.00000  120.00000
   62    67    68   100.00000  107.67100
   62    67    69   100.00000  107.67100
   62    67    72    95.00000  101.59200
   65    70    71    35.00000  120.00000
   70    47    51    63.00000  120.00000
   70    65    66    35.00000  120.00000
   67    62    65    65.00000  117.06700
   67    72    73    50.00000  110.93800
   67    72    74    50.00000  110.93800
   69    67    68   115.00000  120.17200
   72    67    68   115.00000  107.22500
   72    67    69   115.00000  107.22500
   74    72    73    35.00000  109.80100
   48    39    40    70.00000  111.90000
   48    44    47    80.00000  119.64000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    34   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    35   0.01700  1.0 1.0
   24    29    33    35  -0.23550 -1.0 2.0
   24    29    33    35   0.21350  1.0 3.0
   24    29    33    39  -0.23050  1.0 1.0
   24    29    33    39   0.06200 -1.0 2.0
   24    29    33    39   0.47200  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    39    40  -0.16000  1.0 1.0
   29    33    39    40  -0.03200 -1.0 2.0
   29    33    39    40   0.04500  1.0 3.0
   29    33    39    48   0.04300 -1.0 2.0
   33    39    40    41   3.62500 -1.0 2.0
   33    39    40    42   3.62500 -1.0 2.0
   33    39    48    44   3.62500 -1.0 2.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    48   0.21350  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    48   0.21350  1.0 3.0
   39    40    42    43   3.62500 -1.0 2.0
   39    40   -42    44   3.62500 -1.0 2.0
   40    39   -48    44   3.62500 -1.0 2.0
   40    42    43    45  -0.19450  1.0 1.0
   40    42    43    45   0.63300 -1.0 2.0
   40    42    43    45   0.07450  1.0 3.0
   40    42    43    63  -0.19450  1.0 1.0
   40    42    43    63   0.63300 -1.0 2.0
   40    42    43    63   0.07450  1.0 3.0
   40    42    44    47   3.62500 -1.0 2.0
   40    42   -44    48   3.62500 -1.0 2.0
   41    40    42    43   3.62500 -1.0 2.0
   41    40    42    44   3.62500 -1.0 2.0
   42    43    45    46   3.62500 -1.0 2.0
   42    43    45    49   3.62500 -1.0 2.0
   42    43    63    56   3.62500 -1.0 2.0
   42    43    63    64   3.62500 -1.0 2.0
   42    44    47    51   0.57700 -1.0 2.0
   42    44    47    70   0.57700 -1.0 2.0
   42    44   -48    39   3.62500 -1.0 2.0
   43    42    44    47   3.62500 -1.0 2.0
   43    42    44    48   3.62500 -1.0 2.0
   43    45    49    50   3.62500 -1.0 2.0
   43    45    49    53   3.62500 -1.0 2.0
   45    43    63    56   3.62500 -1.0 2.0
   45    43    63    64   3.62500 -1.0 2.0
   45    49   -53    56   3.62500 -1.0 2.0
   45    49    53    58   3.62500 -1.0 2.0
   46    45    49    50   3.62500 -1.0 2.0
   46    45    49    53   3.62500 -1.0 2.0
   49    53    56    57   3.62500 -1.0 2.0
   49    53    56    63   3.62500 -1.0 2.0
   49    53    58    59   0.00000  1.0 1.0
   49    53    58    60   0.00000  1.0 1.0
   49    53    58    61   0.00000  1.0 1.0
   50    49    53    56   3.62500 -1.0 2.0
   50    49    53    58   3.62500 -1.0 2.0
   53    56   -63    43   3.62500 -1.0 2.0
   53    56    63    64   3.62500 -1.0 2.0
   56    53    58    59   0.00000  1.0 1.0
   56    53    58    60   0.00000  1.0 1.0
   56    53    58    61   0.00000  1.0 1.0
   57    56    63    43   3.62500 -1.0 2.0
   57    56    63    64   3.62500 -1.0 2.0
   63    43    45    46   3.62500 -1.0 2.0
   63    43   -45    49   3.62500 -1.0 2.0
   58    53    56    57   3.62500 -1.0 2.0
   58    53    56    63   3.62500 -1.0 2.0
   44    42    43    45  -0.20000  1.0 1.0
   44    42    43    45   0.58050 -1.0 2.0
   44    42    43    63  -0.20000  1.0 1.0
   44    42    43    63   0.58050 -1.0 2.0
   44    47    51    52   3.62500 -1.0 2.0
   44    47    51    54   3.62500 -1.0 2.0
   44    47    70    65   3.62500 -1.0 2.0
   44    47    70    71   3.62500 -1.0 2.0
   47    44    48    39   3.62500 -1.0 2.0
   47    51    54    55   3.62500 -1.0 2.0
   47    51    54    62   3.62500 -1.0 2.0
   51    47    70    65   3.62500 -1.0 2.0
   51    47    70    71   3.62500 -1.0 2.0
   51    54   -62    65   3.62500 -1.0 2.0
   51    54    62    67   3.62500 -1.0 2.0
   52    51    54    55   3.62500 -1.0 2.0
   52    51    54    62   3.62500 -1.0 2.0
   54    62    65    66   3.62500 -1.0 2.0
   54    62    65    70   3.62500 -1.0 2.0
   54    62    67    68   0.19500  1.0 1.0
   54    62    67    68   0.12000 -1.0 2.0
   54    62    67    69   0.19500  1.0 1.0
   54    62    67    69   0.12000 -1.0 2.0
   54    62    67    72  -0.49050  1.0 1.0
   54    62    67    72   0.22250 -1.0 2.0
   54    62    67    72  -0.39350  1.0 3.0
   55    54    62    65   3.62500 -1.0 2.0
   55    54    62    67   3.62500 -1.0 2.0
   62    65   -70    47   3.62500 -1.0 2.0
   62    65    70    71   3.62500 -1.0 2.0
   62    67    72    73   1.01100  1.0 1.0
   62    67    72    73  -0.22250 -1.0 2.0
   62    67    72    73   1.33750  1.0 3.0
   62    67    72    74   1.01100  1.0 1.0
   62    67    72    74  -0.22250 -1.0 2.0
   62    67    72    74   1.33750  1.0 3.0
   65    62    67    68   0.19500  1.0 1.0
   65    62    67    68   0.12000 -1.0 2.0
   65    62    67    69   0.19500  1.0 1.0
   65    62    67    69   0.12000 -1.0 2.0
   65    62    67    72  -0.49050  1.0 1.0
   65    62    67    72   0.22250 -1.0 2.0
   65    62    67    72  -0.39350  1.0 3.0
   66    65    70    47   3.62500 -1.0 2.0
   66    65    70    71   3.62500 -1.0 2.0
   70    47    51    52   3.62500 -1.0 2.0
   70    47   -51    54   3.62500 -1.0 2.0
   67    62    65    66   3.62500 -1.0 2.0
   67    62    65    70   3.62500 -1.0 2.0
   68    67    72    73   1.12100  1.0 1.0
   68    67    72    73   0.54800 -1.0 2.0
   68    67    72    73  -0.29400  1.0 3.0
   68    67    72    74   1.12100  1.0 1.0
   68    67    72    74   0.54800 -1.0 2.0
   68    67    72    74  -0.29400  1.0 3.0
   69    67    72    73   1.12100  1.0 1.0
   69    67    72    73   0.54800 -1.0 2.0
   69    67    72    73  -0.29400  1.0 3.0
   69    67    72    74   1.12100  1.0 1.0
   69    67    72    74   0.54800 -1.0 2.0
   69    67    72    74  -0.29400  1.0 3.0
   48    39    40    41   3.62500 -1.0 2.0
   48    39   -40    42   3.62500 -1.0 2.0
   48    44    47    51   0.90100 -1.0 2.0
   48    44    47    70   0.90100 -1.0 2.0
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
   37    30    36    38  10.50000 -1.0 2.0
   40    48    39    33   4.00000 -1.0 2.0
   42    41    40    39   1.10000 -1.0 2.0
   43    44    42    40   4.00000 -1.0 2.0
   45    63    43    42   4.00000 -1.0 2.0
   49    46    45    43   1.10000 -1.0 2.0
   53    50    49    45   1.10000 -1.0 2.0
   56    58    53    49   4.00000 -1.0 2.0
   63    57    56    53   1.10000 -1.0 2.0
   56    64    63    43   1.10000 -1.0 2.0
   47    48    44    42   4.00000 -1.0 2.0
   51    70    47    44   4.00000 -1.0 2.0
   54    52    51    47   1.10000 -1.0 2.0
   62    55    54    51   1.10000 -1.0 2.0
   65    67    62    54   4.00000 -1.0 2.0
   70    66    65    62   1.10000 -1.0 2.0
   65    71    70    47   1.10000 -1.0 2.0
   74    67    72    73   1.00000 -1.0 2.0
END
