* LIGAND DATABASE FILE (OPLS2005)
*
001      66    66    111    172     328
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02121    73.32054   -92.64046
    3     1 S   H    _H1_     3     1.02057   102.50937    13.42476
    4     1 S   H    _H2_     4     1.02075    40.54322   117.66247
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    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     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08491   110.56590    58.77998
   26    24 S   HC   HB22    34     1.08612   109.94660   179.13182
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CM   _C13    36     1.75666    98.79837   161.84931
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   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   CM   _C10    37     1.45457   114.50793    89.98505
   38    37 S   HC   _H28    38     1.08686   115.60703    42.70057
   39    33 S   CM   _C12    60     1.35185   119.95971   -90.22361
   40    37 S   CM   _C11    39     1.34041   123.47053  -140.22614
   41    40 S   HC   _H29    40     1.08452   121.76201   179.77794
   42    39 S   C    _C15    61     1.49141   122.42778     0.22555
   43    42 S   O    _O16    62     1.21982   126.62962   -29.98248
   44    39 S   OH   _O17    65     1.38777   120.81766  -178.93046
   45    44 S   HO   _H31    66     0.96042   109.38290    -0.00000
   46    40 S   CO4  _C14    41     1.49485   120.62193     0.03956
   47    46 S   O    _O15    42     1.22876   121.09710    31.01590
   48    42 S   OH   _O18    63     1.35489   109.52807   150.74290
   49    48 S   HO   _H32    64     0.98154   111.97202   179.20083
   50    46 S   CT   _C16    43     1.54227   115.94473  -150.03184
   51    50 S   HC   _H30    44     1.10220   104.34397    29.98743
   52    50 S   CA   _C8_    45     1.52605   110.44718   144.64760
   53    50 S   CT   _C17    56     1.55848   113.06675   -84.60143
   54    53 S   Cl   CL21    57     1.80539   110.78129   -36.33189
   55    53 S   Cl   CL22    58     1.80458   110.07406    80.97540
   56    53 S   Cl   CL23    59     1.79269   113.88917  -157.59193
   57    52 S   CA   _C4_    46     1.39566   119.96834    90.00945
   58    57 S   HA   _H24    47     1.08624   120.41670    -0.02798
   59    57 S   CA   _C6_    48     1.39417   119.99005   179.88809
   60    59 S   HA   _H26    49     1.08697   119.18074   179.98022
   61    59 S   CA   _C9_    50     1.39497   120.04051     0.08393
   62    61 S   Cl   CL20    51     1.71997   120.03744  -179.98022
   63    61 S   CA   _C7_    52     1.39566   119.96951    -0.08393
   64    63 S   HA   _H27    53     1.08664   120.81085  -179.93147
   65    52 S   CA   _C5_    54     1.39537   120.05695   -90.06086
   66    65 S   HA   _H25    55     1.08725   120.37655     0.11869
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   7   5   4   3
  11   2   1   1   9   4   7   7   3   5   3   2   1  10   4   1
   1  12   7  13   5   2   1   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    39    42    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    46    39    42    43    48    44    45  
   35    36  
   36  
    0  
   38    40    41    46    47    50    39    42    44  
   40    41    46    39  
   42    43    48    49    44    45    40  
   41    46    47    50    51    52    53  
   46    47    50  
   43    48    49    44    45  
   48    49    44  
   45    48  
    0  
   47    50    51    52    57    65    53    54    55    56  
   50    51    52    53  
   49  
    0  
   51    52    57    58    59    63    65    66    53    54    55    56  
   52    57    65    53    54    55    56  
   57    58    59    60    61    63    64    65    66    53    54    55    56  
   54    55    56    57    65  
   55    56  
   56  
    0  
   58    59    60    61    62    63    65    66  
   59    60    61    65  
   60    61    62    63    64    65  
   61    62    63  
   62    63    64    65    66  
   63    64    65  
   64    65    66  
   65    66  
   66  
    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   3.5500   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   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   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   44   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   46   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   48   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.450000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5000   0.0660   0.313400   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.5000   0.0660  -0.294400   1.9750   1.7500   0.005000000  -0.741685710
   54   3.4000   0.3000   0.012000   2.1950   1.9500   0.001000000   0.320982824
   55   3.4000   0.3000   0.012000   2.1950   1.9500   0.001000000   0.320982824
   56   3.4000   0.3000   0.012000   2.1950   1.9500   0.001000000   0.320982824
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   62   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   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
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   240.000  1.763
   33    37   380.000  1.444
   33    39   549.000  1.340
   37    38   340.000  1.080
   37    40   549.000  1.340
   40    41   340.000  1.080
   40    46   320.000  1.462
   46    47   570.000  1.229
   46    50   317.000  1.522
   50    51   340.000  1.090
   50    52   317.000  1.510
   50    53   268.000  1.529
   52    57   469.000  1.400
   52    65   469.000  1.400
   57    58   367.000  1.080
   57    59   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   300.000  1.725
   61    63   469.000  1.400
   63    64   367.000  1.080
   63    65   469.000  1.400
   65    66   367.000  1.080
   53    54   245.000  1.781
   53    55   245.000  1.781
   53    56   245.000  1.781
   39    42   410.000  1.444
   39    44   510.000  1.338
   42    43   570.000  1.229
   42    48   450.000  1.364
   48    49   553.000  0.945
   44    45   553.000  0.945
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    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    65.00000  122.11800
   29    33    39    65.00000  122.11800
   33    37    38    35.00000  120.00000
   33    37    40    70.00000  123.01800
   33    39    42    70.00000  118.70000
   33    39    44    80.00000  121.38400
   37    40    41    35.00000  120.00000
   37    40    46    65.00000  118.96000
   40    37    38    35.00000  120.00000
   40    46    47    80.00000  123.72100
   40    46    50    65.00000  118.62400
   46    40    41    40.00000  117.72500
   46    50    51    35.00000  109.50000
   46    50    52    70.00000  110.93000
   46    50    53    63.00000  111.10000
   50    46    47    80.00000  120.40000
   50    52    57    70.00000  120.00000
   50    52    65    70.00000  120.00000
   50    53    54    69.00000  109.80000
   50    53    55    69.00000  109.80000
   50    53    56    69.00000  109.80000
   52    50    51    35.00000  109.50000
   52    57    58    35.00000  120.00000
   52    57    59    63.00000  120.00000
   52    65    63    63.00000  120.00000
   52    65    66    35.00000  120.00000
   57    59    60    35.00000  120.00000
   57    59    61    63.00000  120.00000
   59    57    58    35.00000  120.00000
   59    61    62    75.00000  120.00000
   59    61    63    63.00000  120.00000
   61    59    60    35.00000  120.00000
   61    63    64    35.00000  120.00000
   61    63    65    63.00000  120.00000
   63    61    62    75.00000  120.00000
   63    65    66    35.00000  120.00000
   65    52    57    63.00000  120.00000
   65    63    64    35.00000  120.00000
   53    50    51    37.50000  110.70000
   53    50    52    70.00000  112.17500
   55    53    54    80.00000  110.42200
   56    53    54    80.00000  110.42200
   56    53    55    80.00000  110.42200
   39    33    37    70.00000  123.01800
   39    42    43    80.00000  125.30000
   39    42    48    90.00000  111.55000
   39    44    45    70.00000  107.45700
   42    48    49    35.00000  113.00000
   48    42    43   100.00000  123.32000
   44    39    42    80.00000  119.00000
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   0.00000  1.0 1.0
   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   1.00000 -1.0 2.0
   24    29    33    39   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    40  -0.18600  1.0 3.0
   29    33    39    42   7.00000 -1.0 2.0
   29    33    39    44   7.00000 -1.0 2.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    46   7.00000 -1.0 2.0
   33    39    42    43   1.00000 -1.0 2.0
   33    39    42    48  -0.01000  1.0 1.0
   33    39    42    48   1.29850 -1.0 2.0
   33    39    42    48  -0.09550  1.0 3.0
   33    39    44    45  -0.66100  1.0 1.0
   33    39    44    45   1.20850 -1.0 2.0
   33    39    44    45  -0.36000  1.0 3.0
   37    33    39    42   7.00000 -1.0 2.0
   37    33    39    44   7.00000 -1.0 2.0
   37    40    46    47   1.00000 -1.0 2.0
   37    40    46    50  -0.33500  1.0 1.0
   37    40    46    50   1.06600 -1.0 2.0
   37    40    46    50  -0.14000  1.0 3.0
   38    37    40    41   7.00000 -1.0 2.0
   38    37    40    46   7.00000 -1.0 2.0
   40    46    50    51   0.00000  1.0 1.0
   40    46    50    52   0.65300  1.0 1.0
   40    46    50    52  -0.03850 -1.0 2.0
   40    46    50    52   0.33900  1.0 3.0
   40    46    50    53   0.65300  1.0 1.0
   40    46    50    53  -0.03850 -1.0 2.0
   40    46    50    53   0.33900  1.0 3.0
   41    40    46    47   0.00000  1.0 1.0
   41    40    46    50   0.04550  1.0 1.0
   41    40    46    50   0.83000 -1.0 2.0
   41    40    46    50  -0.04000  1.0 3.0
   46    50    52    57   0.04300 -1.0 2.0
   46    50    52    65   0.04300 -1.0 2.0
   46    50    53    54   0.56750  1.0 1.0
   46    50    53    54  -0.07550 -1.0 2.0
   46    50    53    54   0.20000  1.0 3.0
   46    50    53    55   0.56750  1.0 1.0
   46    50    53    55  -0.07550 -1.0 2.0
   46    50    53    55   0.20000  1.0 3.0
   46    50    53    56   0.56750  1.0 1.0
   46    50    53    56  -0.07550 -1.0 2.0
   46    50    53    56   0.20000  1.0 3.0
   47    46    50    51   0.00000  1.0 1.0
   47    46    50    52   0.30150 -1.0 2.0
   47    46    50    53   0.30150 -1.0 2.0
   50    52    57    58   3.62500 -1.0 2.0
   50    52    57    59   3.62500 -1.0 2.0
   50    52    65    63   3.62500 -1.0 2.0
   50    52    65    66   3.62500 -1.0 2.0
   51    50    52    57   0.00000  1.0 1.0
   51    50    52    65   0.00000  1.0 1.0
   51    50    53    54   0.27000  1.0 3.0
   51    50    53    55   0.27000  1.0 3.0
   51    50    53    56   0.27000  1.0 3.0
   52    50    53    54   0.56750  1.0 1.0
   52    50    53    54  -0.07550 -1.0 2.0
   52    50    53    54   0.20000  1.0 3.0
   52    50    53    55   0.56750  1.0 1.0
   52    50    53    55  -0.07550 -1.0 2.0
   52    50    53    55   0.20000  1.0 3.0
   52    50    53    56   0.56750  1.0 1.0
   52    50    53    56  -0.07550 -1.0 2.0
   52    50    53    56   0.20000  1.0 3.0
   52    57    59    60   3.62500 -1.0 2.0
   52    57    59    61   3.62500 -1.0 2.0
   57    52    65    63   3.62500 -1.0 2.0
   57    52    65    66   3.62500 -1.0 2.0
   57    59    61    62   3.62500 -1.0 2.0
   57    59   -61    63   3.62500 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   58    57    59    61   3.62500 -1.0 2.0
   59    61    63    64   3.62500 -1.0 2.0
   59    61    63    65   3.62500 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    63   3.62500 -1.0 2.0
   61    63   -65    52   3.62500 -1.0 2.0
   61    63    65    66   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    65   3.62500 -1.0 2.0
   64    63    65    52   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   65    52    57    58   3.62500 -1.0 2.0
   65    52   -57    59   3.62500 -1.0 2.0
   53    50    52    57   0.04150 -1.0 2.0
   53    50    52    65   0.04150 -1.0 2.0
   39    33    37    38  -0.18600  1.0 3.0
   39    33    37    40   0.28850  1.0 1.0
   39    33    37    40   2.61350 -1.0 2.0
   39    33    37    40   0.78400  1.0 3.0
   39    42    48    49   1.22000  1.0 1.0
   39    42    48    49   0.17300 -1.0 2.0
   42    39    44    45   2.00000 -1.0 2.0
   43    42    48    49   0.92200  1.0 1.0
   43    42    48    49   3.74100 -1.0 2.0
   44    39    42    43  -0.11900  1.0 1.0
   44    39    42    43   0.76850 -1.0 2.0
   44    39    42    43   0.14100  1.0 3.0
   44    39    42    48   1.50000 -1.0 2.0
IPHI
    9     5     7     8  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    34    35  10.50000 -1.0 2.0
   29    37    33    39  15.00000 -1.0 2.0
   33    38    37    40  15.00000 -1.0 2.0
   46    41    40    37  15.00000 -1.0 2.0
   40    50    46    47  10.50000 -1.0 2.0
   57    65    52    50   4.00000 -1.0 2.0
   59    58    57    52   1.10000 -1.0 2.0
   61    60    59    57   1.10000 -1.0 2.0
   63    62    61    59   4.00000 -1.0 2.0
   65    64    63    61   1.10000 -1.0 2.0
   63    66    65    52   1.10000 -1.0 2.0
   42    44    39    33  15.00000 -1.0 2.0
   39    48    42    43  10.50000 -1.0 2.0
END
