* LIGAND DATABASE FILE (OPLS2005)
*
001      66    69    124    202     357
    1     0 S   NP   _N1_     1    29.01805    94.95264   -18.54473
    2     1 S   H    _HN1     2     1.02948    42.28473   134.75863
    3     1 S   H    _H1_     3     1.02774    72.04162   -78.56780
    4     1 S   H    _H2_     4     1.02913    97.93558    28.07080
    5     1 S   CT   _CA1     5     1.50570   145.96974   178.16187
    6     5 S   HC   _HA1     6     1.09679   104.52712    34.45686
    7     5 S   CO3  _C1_     7     1.54528   111.06576   -81.12629
    8     7 S   O2Z  _O11     8     1.26024   116.78356  -126.18752
    9     7 S   O2Z  _O12     9     1.26617   113.71936    53.06234
   10     5 S   CT   _CB1    10     1.53083   106.98849   150.50718
   11    10 S   HC   HB11    11     1.09828   109.98929   -40.65040
   12    10 S   HC   HB12    12     1.09795   110.08576    75.96404
   13    10 S   CT   _CG1    13     1.53155   112.53777  -161.39121
   14    13 S   HC   HG11    14     1.09460   110.76138   -53.90738
   15    13 S   HC   HG12    15     1.09618   110.16875    65.00224
   16    13 S   C    _CD1    16     1.51778   111.53270  -175.39470
   17    16 S   O    _OE1    17     1.22790   122.82335   -23.83250
   18    16 S   N    _N2_    18     1.38571   112.12863   157.06775
   19    18 S   H    _HN2    19     1.01574   119.16099     1.85372
   20    18 S   CT1  _CA2    20     1.46278   123.28048  -175.77182
   21    20 S   HC   _HA2    21     1.09733   109.30045   -17.58059
   22    20 S   C    _C2_    22     1.53343   108.34052  -133.46014
   23    22 S   O    _O2_    23     1.23002   122.29898  -145.13542
   24    20 S   CT   _CB2    32     1.53609   111.30156   104.36082
   25    24 S   HC   HB21    33     1.09583   109.63424    56.09485
   26    24 S   HC   HB22    34     1.09471   110.43971   175.01996
   27    22 S   N    _N3_    24     1.38527   113.27650    42.19470
   28    27 S   H    _HN3    25     1.01536   118.90383    -0.47395
   29    24 S   S    _SG2    35     1.82732   111.61955   -65.01005
   30    27 S   CT   _CA3    26     1.45448   123.38792   175.06509
   31    30 S   HC   HA31    27     1.09528   109.15381    25.79802
   32    30 S   HC   HA32    28     1.09492   107.13724   142.79961
   33    29 S   CT   _C18    36     1.83981    99.94829   161.15118
   34    33 S   HC   _H5_    37     1.09643   107.56517   -44.91260
   35    30 S   CO3  _C3_    29     1.52938   113.19912   -97.61453
   36    35 S   O2Z  _O31    30     1.26396   115.44830   -43.16854
   37    35 S   O2Z  _O32    31     1.26362   114.95099   137.77535
   38    33 S   CT   _C17    38     1.53078   112.32956    75.48713
   39    38 S   HC   _H12    39     1.09520   111.09433   -51.57009
   40    38 S   HC   _H13    40     1.09741   109.46505  -170.03695
   41    38 S   CO4  _C16    41     1.52003   113.35061    71.39485
   42    41 S   O    _O37    42     1.22989   121.55658  -154.05968
   43    41 S   CM   _C15    43     1.48498   118.87960    29.16077
   44    43 S   HC   _H11    44     1.08283   118.48733   176.79228
   45    43 S   CM   _C14    45     1.33930   119.14179    -3.83114
   46    45 S   HC   _H10    46     1.08591   117.31570  -179.26511
   47    33 S   C3T  _C13    47     1.52098   107.69775  -163.27352
   48    47 S   C3T  _C12    48     1.52574   118.23060    76.87247
   49    48 S   HC   _H4_    49     1.08417   118.05222    -7.88879
   50    48 S   CT   _C10    50     1.49150   124.21721  -160.96383
   51    50 S   HC   _H3_    51     1.09606   113.20885   -35.08767
   52    47 S   O3T  _O36    66     1.44406   112.02901   140.67429
   53    50 S   CO4  _C11    52     1.51006   112.74916  -158.18623
   54    53 S   O    _O35    53     1.21566   127.82639    58.20461
   55    50 S   OS   _O34    63     1.45333   109.14578    84.93338
   56    53 S   CA   _C6_    54     1.43763   107.10160  -121.39063
   57    56 S   CA   _C5_    55     1.38034   130.93700  -179.26698
   58    57 S   HA   _H7_    56     1.08372   121.80285     0.58484
   59    57 S   CA   _C4_    57     1.39532   117.02914  -178.76647
   60    59 S   HA   _H6_    58     1.08655   119.30680   179.33736
   61    59 S   CA   _C9_    59     1.40641   120.04231     0.18767
   62    61 S   CA   _C8_    60     1.39714   121.64287    -0.32984
   63    62 S   HA   _H8_    61     1.08426   121.30894   179.80416
   64    61 S   OH   _O33    64     1.36857   120.51555   178.77923
   65    64 S   HO   _H9_    65     0.97302   108.34711     4.73557
   66    56 S   CA   _C7_    62     1.37980   105.79658     1.72329
  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  10   5   4   3
  14   8   2   1   1  10   5   4   6   3   6   3   6   3   7   9
   5   9   6   2   8   4   6   8   7   4   7   3   5   4   2   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    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    45    47    48    52  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    45    46    47    48    49    50    52  
   38    39    40    41    45    47    48    52  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    47    48    52  
   40    41    42    43    47  
   41    42    43    47  
   42    43    44    45    46    47  
   43    44    45  
   44    45    46    47    48    52  
   45    46    47  
   46    47    48    49    50    52  
   47    48    52  
   48    49    50    51    53    55    52  
   49    50    51    53    54    56    66    55    52  
   50    51    53    55    52  
   51    53    54    56    57    62    66    55    52  
   53    54    56    66    55    52  
   53    55  
   54    56    57    58    59    62    66    55  
   56    57    66    55  
   56    57    61    62    63    66  
   57    58    59    60    61    62    63    66  
   58    59    60    61    62    66    64  
   59    60    61    66  
   60    61    62    63    66    64    65  
   61    62    64  
   62    63    66    64    65  
   63    66    64    65  
   66    64  
   65    66  
    0  
    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  -0.335000   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   48   3.5000   0.0660   0.099700   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.234500   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   2.9000   0.1400  -0.352400   1.7660   1.5600   0.020110767  -0.896042159
   53   3.7500   0.1050   0.537000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   55   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   56   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
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   340.000  1.090
   33    38   268.000  1.529
   33    47   275.000  1.510
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   317.000  1.522
   41    42   570.000  1.229
   41    43   320.000  1.462
   43    44   340.000  1.080
   43    45   549.000  1.340
   45    46   340.000  1.080
   45    47   305.000  1.480
   47    48   260.000  1.509
   47    52   335.000  1.432
   48    49   340.000  1.088
   48    50   275.000  1.510
   48    52   335.000  1.432
   50    51   340.000  1.090
   50    53   317.000  1.522
   50    55   320.000  1.410
   53    54   570.000  1.229
   53    56   310.000  1.470
   56    57   469.000  1.400
   56    66   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   469.000  1.400
   61    64   450.000  1.364
   62    63   367.000  1.080
   62    66   469.000  1.400
   66    55   450.000  1.364
   64    65   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    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    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    47    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    63.00000  111.10000
   33    47    45    65.00000  117.55000
   33    47    48    60.00000  120.94000
   33    47    52    80.00000  116.47100
   38    33    34    37.50000  110.70000
   38    41    42    80.00000  120.40000
   38    41    43    65.00000  118.62400
   40    38    39    33.00000  107.80000
   41    38    39    35.00000  109.50000
   41    38    40    35.00000  109.50000
   41    43    44    40.00000  117.72500
   41    43    45    65.00000  118.96000
   43    41    42    80.00000  123.72100
   43    45    46    35.00000  120.00000
   43    45    47    55.00000  125.06700
   45    43    44    35.00000  120.00000
   45    47    48    60.00000  120.58800
   45    47    52    85.00000  114.23300
   47    33    34    45.00000  109.38400
   47    33    38    70.00000  112.37300
   47    45    46    40.00000  117.24000
   47    48    49    37.50000  117.20000
   47    48    50    60.00000  120.94000
   47    48    52    15.00000   60.43100
   47    52    48    15.00000   59.14900
   48    50    51    45.00000  109.38400
   48    50    53    63.00000  111.10000
   48    50    55    50.00000  109.50000
   50    48    49    40.00000  115.04500
   50    53    54    80.00000  120.40000
   50    53    56    65.00000  115.47100
   50    55    66    75.00000  111.00000
   53    50    51    35.00000  109.50000
   53    56    57    60.00000  119.52600
   53    56    66    60.00000  119.52600
   56    53    54    75.00000  123.78400
   56    57    58    35.00000  120.00000
   56    57    59    63.00000  120.00000
   56    66    62    63.00000  120.00000
   56    66    55    70.00000  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    63.00000  120.00000
   59    61    64    70.00000  120.00000
   61    59    60    35.00000  120.00000
   61    62    63    35.00000  120.00000
   61    62    66    63.00000  120.00000
   61    64    65    35.00000  113.00000
   62    66    55    70.00000  120.00000
   66    56    57    63.00000  120.00000
   66    62    63    35.00000  120.00000
   55    50    51    35.00000  109.50000
   55    50    53    90.00000  108.74100
   64    61    62    70.00000  120.00000
   52    47    48    15.00000   60.43100
   52    48    49    50.00000  114.27700
   52    48    50    80.00000  116.47100
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   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   0.21350  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   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    47    45   0.56750  1.0 1.0
   29    33    47    45  -0.07550 -1.0 2.0
   29    33    47    45   0.20000  1.0 3.0
   29    33    47    48   0.44750  1.0 1.0
   29    33    47    48  -0.17800 -1.0 2.0
   29    33    47    48   0.20200  1.0 3.0
   29    33    47    52   0.56750  1.0 1.0
   29    33    47    52  -0.07550 -1.0 2.0
   29    33    47    52   0.20000  1.0 3.0
   33    38    41    42   0.30150 -1.0 2.0
   33    38    41    43   0.65300  1.0 1.0
   33    38    41    43  -0.03850 -1.0 2.0
   33    38    41    43   0.33900  1.0 3.0
   33    47    48    49   0.15000  1.0 3.0
   33    47    48    50   0.56750  1.0 1.0
   33    47    48    50  -0.07550 -1.0 2.0
   33    47    48    50   0.20000  1.0 3.0
   33    47   -48    52   0.02550  1.0 1.0
   33    47   -48    52  -0.02600 -1.0 2.0
   33    47   -48    52   1.20400  1.0 3.0
   33    47   -52    48   0.06250  1.0 1.0
   33    47   -52    48  -0.01100 -1.0 2.0
   33    47   -52    48   0.28050  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41  -0.11250  1.0 3.0
   34    33    47    45   0.15000  1.0 3.0
   34    33    47    48   0.15000  1.0 3.0
   34    33    47    52   0.23400  1.0 3.0
   38    33    47    45   0.34400  1.0 1.0
   38    33    47    45   0.09450 -1.0 2.0
   38    33    47    45   0.11100  1.0 3.0
   38    33    47    48   0.07850  1.0 1.0
   38    33    47    48  -0.03950 -1.0 2.0
   38    33    47    48   0.67350  1.0 3.0
   38    33    47    52   0.02550  1.0 1.0
   38    33    47    52  -0.02600 -1.0 2.0
   38    33    47    52   1.20400  1.0 3.0
   38    41    43    44   0.04550  1.0 1.0
   38    41    43    44   0.83000 -1.0 2.0
   38    41    43    44  -0.04000  1.0 3.0
   38    41   -43    45  -0.33500  1.0 1.0
   38    41   -43    45   1.06600 -1.0 2.0
   38    41   -43    45  -0.14000  1.0 3.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    43   0.00000  1.0 1.0
   40    38    41    42   0.00000  1.0 1.0
   40    38    41    43   0.00000  1.0 1.0
   41    43    45    46   7.00000 -1.0 2.0
   41    43    45    47   7.00000 -1.0 2.0
   42    41    43    44   0.00000  1.0 1.0
   42    41    43    45   1.00000 -1.0 2.0
   43    45   -47    33   0.09850  1.0 1.0
   43    45   -47    33   0.15250 -1.0 2.0
   43    45   -47    33  -0.50650  1.0 3.0
   43    45    47    48   0.09850  1.0 1.0
   43    45    47    48   0.15250 -1.0 2.0
   43    45    47    48  -0.50650  1.0 3.0
   43    45    47    52   0.39000  1.0 1.0
   43    45    47    52  -0.05800 -1.0 2.0
   43    45    47    52  -0.55150  1.0 3.0
   44    43    45    46   7.00000 -1.0 2.0
   44    43    45    47   7.00000 -1.0 2.0
   45    47    48    49   0.15000  1.0 3.0
   45    47    48    50   0.34400  1.0 1.0
   45    47    48    50   0.09450 -1.0 2.0
   45    47    48    50   0.11100  1.0 3.0
   45    47   -48    52   0.61850  1.0 1.0
   45    47   -48    52  -0.22750 -1.0 2.0
   45    47   -48    52   0.15300  1.0 3.0
   45    47   -52    48  -0.77900  1.0 1.0
   45    47   -52    48  -0.36900 -1.0 2.0
   45    47   -52    48   0.40400  1.0 3.0
   46    45    47    33   0.00000  1.0 1.0
   46    45    47    48   0.00000  1.0 1.0
   46    45    47    52   0.00000  1.0 1.0
   47    33    38    39   0.15000  1.0 3.0
   47    33    38    40   0.15000  1.0 3.0
   47    33   -38    41  -0.95700  1.0 1.0
   47    33   -38    41  -0.18200 -1.0 2.0
   47    33   -38    41   0.29450  1.0 3.0
   47    48    50    51   0.15000  1.0 3.0
   47    48    50    53  -0.95700  1.0 1.0
   47    48    50    53  -0.18200 -1.0 2.0
   47    48    50    53   0.29450  1.0 3.0
   47    48    50    55  -0.26800  1.0 1.0
   47    48    50    55   0.69150 -1.0 2.0
   47    48    50    55  -0.48750  1.0 3.0
   48    50    53    54   0.30150 -1.0 2.0
   48    50    53    56   0.05850 -1.0 2.0
   48    50    53    56   0.17250  1.0 3.0
   48    50    55    66  -0.32850  1.0 1.0
   48    50    55    66  -0.35800 -1.0 2.0
   48    50    55    66   0.33950  1.0 3.0
   49    48    50    51   0.15000  1.0 3.0
   49    48    50    53  -0.11250  1.0 3.0
   49    48    50    55   0.23400  1.0 3.0
   49    48   -52    47   0.36800  1.0 3.0
   50    48   -52    47   0.06250  1.0 1.0
   50    48   -52    47  -0.01100 -1.0 2.0
   50    48   -52    47   0.28050  1.0 3.0
   50    53    56    57   2.26350  1.0 1.0
   50    53    56    57   0.76750 -1.0 2.0
   50    53    56    57   0.22500  1.0 3.0
   50    53   -56    66   2.26350  1.0 1.0
   50    53   -56    66   0.76750 -1.0 2.0
   50    53   -56    66   0.22500  1.0 3.0
   51    50    53    54   0.00000  1.0 1.0
   51    50    53    56   0.00000  1.0 1.0
   51    50    55    66   0.08050  1.0 3.0
   53    50   -55    66  -0.25600  1.0 1.0
   53    50   -55    66  -0.40050 -1.0 2.0
   53    50   -55    66   0.34700  1.0 3.0
   53    56    57    58   3.62500 -1.0 2.0
   53    56    57    59   3.62500 -1.0 2.0
   53    56    66    62   3.62500 -1.0 2.0
   53    56   -66    55   3.62500 -1.0 2.0
   54    53    56    57   1.05000 -1.0 2.0
   54    53    56    66   1.05000 -1.0 2.0
   56    57    59    60   3.62500 -1.0 2.0
   56    57    59    61   3.62500 -1.0 2.0
   56    66   -55    50   1.63200 -1.0 2.0
   57    56    66    62   3.62500 -1.0 2.0
   57    56    66    55   3.62500 -1.0 2.0
   57    59   -61    62   3.62500 -1.0 2.0
   57    59    61    64   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    62    63   3.62500 -1.0 2.0
   59    61    62    66   3.62500 -1.0 2.0
   59    61    64    65   0.84100 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    64   3.62500 -1.0 2.0
   61    62   -66    56   3.62500 -1.0 2.0
   61    62    66    55   3.62500 -1.0 2.0
   62    61    64    65   0.84100 -1.0 2.0
   62    66    55    50   1.63200 -1.0 2.0
   63    62    66    56   3.62500 -1.0 2.0
   63    62    66    55   3.62500 -1.0 2.0
   66    56    57    58   3.62500 -1.0 2.0
   66    56   -57    59   3.62500 -1.0 2.0
   55    50    53    54   0.30150 -1.0 2.0
   55    50   -53    56   0.65300  1.0 1.0
   55    50   -53    56  -0.03850 -1.0 2.0
   55    50   -53    56   0.33900  1.0 3.0
   64    61    62    63   3.62500 -1.0 2.0
   64    61    62    66   3.62500 -1.0 2.0
   52    47   -48    49   0.23400  1.0 3.0
   52    47   -48    50   0.02550  1.0 1.0
   52    47   -48    50  -0.02600 -1.0 2.0
   52    47   -48    50   1.20400  1.0 3.0
   52    48    50    51   0.23400  1.0 3.0
   52    48    50    53  -0.09450  1.0 1.0
   52    48    50    53  -1.12950 -1.0 2.0
   52    48    50    53   0.54000  1.0 3.0
   52    48    50    55   1.11900  1.0 1.0
   52    48    50    55  -1.16350 -1.0 2.0
   52    48    50    55  -0.34150  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
   36    30    35    37  10.50000 -1.0 2.0
   38    43    41    42  10.50000 -1.0 2.0
   41    44    43    45   1.10000 -1.0 2.0
   47    46    45    43   1.10000 -1.0 2.0
   50    56    53    54  10.50000 -1.0 2.0
   57    66    56    53   4.00000 -1.0 2.0
   59    58    57    56   1.10000 -1.0 2.0
   61    60    59    57   1.10000 -1.0 2.0
   62    64    61    59   4.00000 -1.0 2.0
   66    63    62    61   1.10000 -1.0 2.0
   62    55    66    56   4.00000 -1.0 2.0
END
