* LIGAND DATABASE FILE (OPLS2005)
*
001      63    64    109    174     321
    1     0 S   NP   _N1_     1    29.15167    95.94107   -20.32809
    2     1 S   H    _HN1     2     1.02964    89.18038    52.26608
    3     1 S   H    _H1_     3     1.02810    38.61348   171.19542
    4     1 S   H    _H2_     4     1.02750    82.27108   -56.48491
    5     1 S   CT   _CA1     5     1.50320   148.91080  -177.77068
    6     5 S   HC   _HA1     6     1.09601   104.94044    51.87026
    7     5 S   CO3  _C1_     7     1.53859   112.60719   -67.24643
    8     7 S   O2Z  _O11     8     1.26360   114.94897   -30.29950
    9     7 S   O2Z  _O12     9     1.26295   114.97461   147.96308
   10     5 S   CT   _CB1    10     1.53085   107.13950   169.24428
   11    10 S   HC   HB11    11     1.09795   108.75260   -51.10419
   12    10 S   HC   HB12    12     1.09786   110.39048    65.10427
   13    10 S   CT   _CG1    13     1.52957   113.07879  -172.58754
   14    13 S   HC   HG11    14     1.09561   110.10486   -71.12091
   15    13 S   HC   HG12    15     1.09672   110.13328    47.75200
   16    13 S   C    _CD1    16     1.51992   112.63685   167.21161
   17    16 S   O    _OE1    17     1.22747   123.29044   -14.43871
   18    16 S   N    _N2_    18     1.38587   111.69019   167.89134
   19    18 S   H    _HN2    19     1.01574   118.78929    -2.65107
   20    18 S   CT1  _CA2    20     1.46231   123.65370   177.20425
   21    20 S   HC   _HA2    21     1.09730   109.46132   -13.31517
   22    20 S   C    _C2_    22     1.53497   107.90450  -128.72906
   23    22 S   O    _O2_    23     1.23016   122.35134  -145.31238
   24    20 S   CT   _CB2    32     1.53347   111.38655   109.27781
   25    24 S   HC   HB21    33     1.09381   109.24308    51.65458
   26    24 S   HC   HB22    34     1.09506   110.70739   169.86465
   27    22 S   N    _N3_    24     1.38547   113.33778    42.07239
   28    27 S   H    _HN3    25     1.01534   118.86982    -0.72712
   29    24 S   S    _SG2    35     1.83077   111.54927   -71.49045
   30    27 S   CT   _CA3    26     1.45429   123.43515   175.19160
   31    30 S   HC   HA31    27     1.09527   109.19053    25.38856
   32    30 S   HC   HA32    28     1.09496   107.13860   142.36852
   33    29 S   CT   _C16    36     1.85880   101.27995   145.07333
   34    33 S   Cl   Cl1_    37     1.81763   108.46617   174.91685
   35    30 S   CO3  _C3_    29     1.52917   113.12187   -98.06551
   36    35 S   O2Z  _O31    30     1.26403   115.41033   -45.16959
   37    35 S   O2Z  _O32    31     1.26356   114.98327   135.77104
   38    33 S   CM   _C15    38     1.51884   106.98052    62.50975
   39    38 S   HC   _H11    39     1.08857   118.38096    54.65331
   40    38 S   CM   _C14    40     1.33880   123.27254  -125.66349
   41    40 S   HC   _H10    41     1.08485   119.83022  -179.54243
   42    40 S   CM   _C13    42     1.43819   119.96217    -0.47970
   43    42 S   CM   _C12    43     1.34360   122.98428     0.76872
   44    43 S   HC   _H9_    44     1.08547   119.75990  -179.15050
   45    42 S   NO2  _N5_    61     1.46119   119.72982  -179.01921
   46    45 S   ON   _O35    62     1.23894   117.11367   -25.92453
   47    45 S   ON   _O34    63     1.23918   118.46801   153.58995
   48    33 S   CM   _C11    45     1.55613   111.79814   -64.73356
   49    48 S   CMA  _C10    46     1.37384   123.64351   -57.91122
   50    49 S   OM   _O33    47     1.26420   128.86771    -0.38614
   51    49 S   NE   _N4_    48     1.39919   120.72588   174.29869
   52    51 S   H    _H8_    49     1.01358   114.72746   -35.62121
   53    51 S   CA   _C7_    50     1.41556   131.44245   137.87925
   54    53 S   CA   _C6_    51     1.40561   118.38703   164.18645
   55    54 S   HA   _H5_    52     1.08778   120.15483     0.57573
   56    54 S   CA   _C5_    53     1.39689   121.15185  -178.59598
   57    56 S   HA   _H4_    54     1.08600   119.89568   179.57113
   58    56 S   CA   _C4_    55     1.39152   120.00416     0.20936
   59    58 S   HA   _H3_    56     1.08573   120.12416   179.71814
   60    58 S   CA   _C9_    57     1.39218   119.74395     0.06853
   61    60 S   HA   _H7_    58     1.08616   120.00052   179.87489
   62    53 S   CA   _C8_    59     1.40272   123.63574   -13.73712
   63    62 S   HA   _H6_    60     1.08672   120.87553    -2.53706
  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   8   5   4   3
  12   6   2   1   1   8   4   8   3   7   8   3   3   1   1   5
   6   3   8   3   9   8   4   6   3   5   3   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    48    49  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    48    49    50    51  
   38    39    40    43    48    49  
   36    37  
   37  
    0  
   39    40    41    42    43    48    49    45  
   40    41    42    48  
   41    42    43    44    48    45    46    47  
   42    43    45  
   43    44    48    49    45    46    47  
   44    48    49    50    51    45    46    47  
   48    49    45  
   46    47    48  
   47  
    0  
   49    50    51    52    53  
   50    51    52    53    54    62  
   51    52    53  
   52    53    54    55    56    60    62    63  
   53    54    62  
   54    55    56    57    58    60    61    62    63  
   55    56    57    58    59    60    62    63  
   56    57    58    62  
   57    58    59    60    61    62  
   58    59    60  
   59    60    61    62    63  
   60    61    62  
   61    62    63  
   62    63  
   63  
    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   0.207500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760   0.290900   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.2500   0.1200   0.449100   1.8650   1.6500   0.020864068  -0.347800883
   46   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   47   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   48   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   50   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   51   3.2500   0.1700  -1.076200   1.8650   1.6500   0.051222218  -2.220205820
   52   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   53   3.5500   0.0700   0.200000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700  -0.115000   2.5000   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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   245.000  1.781
   33    38   317.000  1.510
   33    48   317.000  1.510
   38    39   340.000  1.080
   38    40   549.000  1.340
   40    41   340.000  1.080
   40    42   380.000  1.444
   42    43   549.000  1.340
   42    45   325.000  1.425
   43    44   340.000  1.080
   43    48   380.000  1.444
   48    49   465.000  1.376
   49    50   745.000  1.250
   49    51   415.000  1.382
   51    52   434.000  1.010
   51    53   481.000  1.340
   53    54   469.000  1.400
   53    62   469.000  1.400
   54    55   367.000  1.080
   54    56   469.000  1.400
   56    57   367.000  1.080
   56    58   469.000  1.400
   58    59   367.000  1.080
   58    60   469.000  1.400
   60    61   367.000  1.080
   60    62   469.000  1.400
   62    63   367.000  1.080
   45    46   550.000  1.225
   45    47   550.000  1.225
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    85.00000  110.65400
   29    33    38    75.00000  112.20000
   29    33    48    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    48    43    70.00000  124.00000
   33    48    49    70.00000  124.00000
   38    33    34    75.00000  111.90500
   38    40    41    35.00000  120.00000
   38    40    42    70.00000  123.01800
   40    38    39    35.00000  120.00000
   40    42    43    70.00000  123.01800
   40    42    45    70.00000  118.30600
   42    40    41    35.00000  120.00000
   42    43    44    35.00000  120.00000
   42    43    48    70.00000  123.01800
   42    45    46    90.00000  119.02900
   42    45    47    90.00000  119.02900
   43    48    49    70.00000  117.34000
   48    33    34    75.00000  111.90500
   48    33    38    70.00000  110.12100
   48    43    44    35.00000  120.00000
   48    49    50    65.00000  137.10300
   48    49    51    75.00000  114.40000
   49    51    52    50.00000  121.48000
   49    51    53    75.00000  121.78000
   51    49    50   105.00000  113.92000
   51    53    54    70.00000  120.10000
   51    53    62    70.00000  120.10000
   53    51    52    35.00000  113.50000
   53    54    55    35.00000  120.00000
   53    54    56    63.00000  120.00000
   53    62    60    63.00000  120.00000
   53    62    63    35.00000  120.00000
   54    56    57    35.00000  120.00000
   54    56    58    63.00000  120.00000
   56    54    55    35.00000  120.00000
   56    58    59    35.00000  120.00000
   56    58    60    63.00000  120.00000
   58    56    57    35.00000  120.00000
   58    60    61    35.00000  120.00000
   58    60    62    63.00000  120.00000
   60    58    59    35.00000  120.00000
   60    62    63    35.00000  120.00000
   62    53    54    63.00000  120.00000
   62    60    61    35.00000  120.00000
   45    42    43    70.00000  118.30600
   47    45    46    80.00000  125.30000
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    48  -0.62250  1.0 1.0
   24    29    33    48  -0.38450 -1.0 2.0
   24    29    33    48   0.81900  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    38    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    48    43   0.42700  1.0 1.0
   29    33    48    43  -0.70350 -1.0 2.0
   29    33    48    43  -0.43150  1.0 3.0
   29    33    48    49   0.42700  1.0 1.0
   29    33    48    49  -0.70350 -1.0 2.0
   29    33    48    49  -0.43150  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   33    48    49    50   7.00000 -1.0 2.0
   33    48    49    51   7.00000 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.09700  1.0 1.0
   34    33    38    40   0.15600 -1.0 2.0
   34    33    38    40  -0.50800  1.0 3.0
   34    33    48    43   0.09700  1.0 1.0
   34    33    48    43   0.15600 -1.0 2.0
   34    33    48    43  -0.50800  1.0 3.0
   34    33    48    49   0.09700  1.0 1.0
   34    33    48    49   0.15600 -1.0 2.0
   34    33    48    49  -0.50800  1.0 3.0
   38    33    48    43  -0.28300  1.0 1.0
   38    33    48    43   0.26700 -1.0 2.0
   38    33    48    43  -0.63300  1.0 3.0
   38    33    48    49  -0.28300  1.0 1.0
   38    33    48    49   0.26700 -1.0 2.0
   38    33    48    49  -0.63300  1.0 3.0
   38    40   -42    43   0.28850  1.0 1.0
   38    40   -42    43   2.61350 -1.0 2.0
   38    40   -42    43   0.78400  1.0 3.0
   38    40    42    45  -0.18600  1.0 3.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    43    44   7.00000 -1.0 2.0
   40    42    43    48   7.00000 -1.0 2.0
   40    42    45    46   0.65450 -1.0 2.0
   40    42    45    47   0.65450 -1.0 2.0
   41    40    42    43  -0.18600  1.0 3.0
   41    40    42    45   0.00000  1.0 1.0
   42    43   -48    33  -0.18600  1.0 3.0
   42    43    48    49   0.28850  1.0 1.0
   42    43    48    49   2.61350 -1.0 2.0
   42    43    48    49   0.78400  1.0 3.0
   43    42    45    46   0.65450 -1.0 2.0
   43    42    45    47   0.65450 -1.0 2.0
   43    48    49    50   7.00000 -1.0 2.0
   43    48    49    51   7.00000 -1.0 2.0
   44    43    48    33   0.00000  1.0 1.0
   44    43    48    49  -0.18600  1.0 3.0
   48    33    38    39   0.00000  1.0 1.0
   48    33   -38    40  -0.28300  1.0 1.0
   48    33   -38    40   0.26700 -1.0 2.0
   48    33   -38    40  -0.63300  1.0 3.0
   48    49    51    52   1.00000 -1.0 2.0
   48    49    51    53  -0.54500  1.0 1.0
   48    49    51    53   1.14150 -1.0 2.0
   49    51    53    54   0.70250  1.0 1.0
   49    51    53    54   1.56150 -1.0 2.0
   49    51    53    62   0.70250  1.0 1.0
   49    51    53    62   1.56150 -1.0 2.0
   50    49    51    52   1.00000 -1.0 2.0
   50    49    51    53   1.00000 -1.0 2.0
   51    53    54    55   3.62500 -1.0 2.0
   51    53    54    56   3.62500 -1.0 2.0
   51    53    62    60   3.62500 -1.0 2.0
   51    53    62    63   3.62500 -1.0 2.0
   52    51    53    54   1.00000 -1.0 2.0
   52    51    53    62   1.00000 -1.0 2.0
   53    54    56    57   3.62500 -1.0 2.0
   53    54    56    58   3.62500 -1.0 2.0
   54    53    62    60   3.62500 -1.0 2.0
   54    53    62    63   3.62500 -1.0 2.0
   54    56    58    59   3.62500 -1.0 2.0
   54    56   -58    60   3.62500 -1.0 2.0
   55    54    56    57   3.62500 -1.0 2.0
   55    54    56    58   3.62500 -1.0 2.0
   56    58    60    61   3.62500 -1.0 2.0
   56    58    60    62   3.62500 -1.0 2.0
   57    56    58    59   3.62500 -1.0 2.0
   57    56    58    60   3.62500 -1.0 2.0
   58    60   -62    53   3.62500 -1.0 2.0
   58    60    62    63   3.62500 -1.0 2.0
   59    58    60    61   3.62500 -1.0 2.0
   59    58    60    62   3.62500 -1.0 2.0
   61    60    62    53   3.62500 -1.0 2.0
   61    60    62    63   3.62500 -1.0 2.0
   62    53    54    55   3.62500 -1.0 2.0
   62    53   -54    56   3.62500 -1.0 2.0
   45    42    43    44   7.00000 -1.0 2.0
   45    42    43    48   7.00000 -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
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   40    45    42    43   1.10000 -1.0 2.0
   48    44    43    42   1.10000 -1.0 2.0
   33    43    48    49   1.10000 -1.0 2.0
   51    50    49    48   1.10000 -1.0 2.0
   52    49    51    53   1.00000 -1.0 2.0
   54    62    53    51   4.00000 -1.0 2.0
   56    55    54    53   1.10000 -1.0 2.0
   58    57    56    54   1.10000 -1.0 2.0
   60    59    58    56   1.10000 -1.0 2.0
   62    61    60    58   1.10000 -1.0 2.0
   60    63    62    53   1.10000 -1.0 2.0
   46    42    45    47  10.50000 -1.0 2.0
END
