* LIGAND DATABASE FILE (OPLS2005)
*
001      60    61    105    165     309
    1     0 S   NP   _N1_     1    29.07651    93.73215   -19.86306
    2     1 S   H    _HN1     2     1.02964   103.90843    39.52155
    3     1 S   H    _H1_     3     1.02838    30.11836   139.58430
    4     1 S   H    _H2_     4     1.02781    80.98969   -67.23194
    5     1 S   CT   _CA1     5     1.50072   135.84313  -179.98022
    6     5 S   HC   _HA1     6     1.09567   105.33463    38.76489
    7     5 S   CO3  _C1_     7     1.53881   112.34337   -81.65781
    8     7 S   O2Z  _O11     8     1.26351   115.01013   -45.45186
    9     7 S   O2Z  _O12     9     1.26247   114.95998   134.05520
   10     5 S   CT   _CB1    10     1.53131   107.46550   156.80512
   11    10 S   HC   HB11    11     1.09808   109.58747   -50.23254
   12    10 S   HC   HB12    12     1.09833   110.34167    66.39122
   13    10 S   CT   _CG1    13     1.52968   112.50125  -171.40312
   14    13 S   HC   HG11    14     1.09418   110.23676   -56.30351
   15    13 S   HC   HG12    15     1.09607   110.30073    62.55415
   16    13 S   C    _CD1    16     1.51738   111.92041  -177.45863
   17    16 S   O    _OE1    17     1.22746   122.89550   -25.12468
   18    16 S   N    _N2_    18     1.38512   111.90520   156.22361
   19    18 S   H    _HN2    19     1.01581   119.09560     0.23239
   20    18 S   CT1  _CA2    20     1.46175   123.59761  -179.24931
   21    20 S   HC   _HA2    21     1.09733   109.36114   -17.70934
   22    20 S   C    _C2_    22     1.53476   107.95000  -133.29254
   23    22 S   O    _O2_    23     1.22997   122.36912  -145.12929
   24    20 S   CT   _CB2    32     1.53507   111.38336   104.67545
   25    24 S   HC   HB21    33     1.09577   109.66390    51.50317
   26    24 S   HC   HB22    34     1.09313   110.13199   170.31773
   27    22 S   N    _N3_    24     1.38547   113.26912    42.18145
   28    27 S   H    _HN3    25     1.01534   118.90641    -0.45500
   29    24 S   S    _SG2    35     1.82900   111.81671   -69.86350
   30    27 S   CT   _CA3    26     1.45455   123.46662   175.21734
   31    30 S   HC   HA31    27     1.09521   109.24957    23.83074
   32    30 S   HC   HA32    28     1.09495   107.10393   140.84313
   33    29 S   CT   _C14    36     1.84491   100.05693   165.23514
   34    33 S   HC   _H3_    37     1.09247   109.02356   -22.39864
   35    30 S   CO3  _C3_    29     1.52931   113.16739   -99.65771
   36    35 S   O2Z  _O31    30     1.26397   115.43821   -43.07897
   37    35 S   O2Z  _O32    31     1.26359   114.95644   137.87641
   38    33 S   CD   _C12    38     1.53190   105.94754  -140.58768
   39    38 S   CM   _C10    39     1.49331   117.59636   -85.05657
   40    39 S   HC   _H23    40     1.08586   116.49941   167.86960
   41    38 S   NI   _N13    48     1.30417   125.64352    92.55102
   42    39 S   CM   _C11    41     1.33597   121.90702   -10.32268
   43    42 S   Cl   CL17    42     1.72208   120.97141   177.18325
   44    41 S   CA   _C8_    49     1.40137   121.10526     0.22117
   45    42 S   CO4  _C13    43     1.48987   121.36598    -4.47615
   46    45 S   O    _O14    44     1.22885   120.59781   171.72834
   47    44 S   CA   _C4_    50     1.40049   119.83046   -99.05263
   48    47 S   HA   _H19    51     1.08730   120.04324     1.62353
   49    33 S   CT   _C15    45     1.53220   114.93478    99.43205
   50    49 S   Cl   CL18    46     1.77963   113.12614   -61.08079
   51    49 S   HC   _H25    47     1.09742   109.14047  -178.08807
   52    47 S   CA   _C6_    52     1.39540   120.52244  -177.98637
   53    52 S   HA   _H21    53     1.08595   119.55792   179.79442
   54    52 S   CA   _C9_    54     1.39242   119.44796     0.38512
   55    54 S   CA   _C7_    55     1.39196   120.79044     0.45370
   56    55 S   HA   _H22    56     1.08619   120.50758   179.36449
   57    54 S   OH   _O15    59     1.36615   121.00490   179.97202
   58    57 S   HO   _H26    60     0.97263   108.53754    -1.65008
   59    44 S   CA   _C5_    57     1.40081   120.82890    84.56665
   60    59 S   HA   _H20    58     1.08692   120.14637    -1.91704
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  12   7   2   1   1  12   8   4   9   6   3   9   4   3   8   4
   2   1   1   7   3   6   5   3   2   1   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    49    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    45    49    50    51    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    42    45    46    49    50    51    41    44  
   38    39    45    49    50    51    41  
   36    37  
   37  
    0  
   39    40    42    43    45    49    50    51    41    44    47    59  
   40    42    43    45    46    49    41    44  
   42    43    45    41  
   44    47    48    52    55    59    60    42    49  
   43    45    46    49    50    51  
   45    46    49  
   47    48    52    53    54    55    56    59    60  
   46    49    50    51  
   49    50    51  
   48    52    53    54    55    59    60    57  
   52    53    54    59  
   50    51  
   51  
    0  
   53    54    55    56    59    57    58  
   54    55    57  
   55    56    59    60    57    58  
   56    59    60    57    58  
   59    60    57  
   58    59  
    0  
   60  
    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   0.143600   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   3.7500   0.1050   0.356900   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.2800   0.1700  -0.468500   1.8540   1.6400   0.005000000   0.000000000
   42   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   44   3.5500   0.0700   0.078800   2.0020   1.7750   0.001000000  -0.843144165
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   51   2.4200   0.0150   0.103000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   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
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   270.000  1.508
   33    49   268.000  1.529
   38    39   320.000  1.464
   38    41   500.000  1.261
   39    40   340.000  1.080
   39    42   549.000  1.340
   42    43   300.000  1.725
   42    45   320.000  1.462
   45    46   570.000  1.229
   45    49   317.000  1.522
   49    50   245.000  1.781
   49    51   340.000  1.090
   41    44   400.000  1.385
   44    47   469.000  1.400
   44    59   469.000  1.400
   47    48   367.000  1.080
   47    52   469.000  1.400
   52    53   367.000  1.080
   52    54   469.000  1.400
   54    55   469.000  1.400
   54    57   450.000  1.364
   55    56   367.000  1.080
   55    59   469.000  1.400
   59    60   367.000  1.080
   57    58   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  114.43000
   29    33    49    75.00000  111.63000
   33    38    39    65.00000  117.24000
   33    38    41    65.00000  122.10100
   33    49    45    63.00000  111.10000
   33    49    50    69.00000  109.80000
   33    49    51    37.50000  110.70000
   38    33    34    45.00000  109.49600
   38    39    40    40.00000  114.85300
   38    39    42    60.00000  120.31500
   38    41    44    70.00000  113.96500
   39    42    43    75.00000  121.50000
   39    42    45    65.00000  118.96000
   42    39    40    35.00000  120.00000
   42    45    46    80.00000  123.72100
   42    45    49    65.00000  118.62400
   45    42    43    70.00000  120.00000
   45    49    50    70.00000  110.66000
   45    49    51    35.00000  109.50000
   49    33    34    37.50000  110.70000
   49    33    38    70.00000  111.76100
   49    45    46    80.00000  120.40000
   51    49    50    51.00000  107.60000
   41    38    39    70.00000  121.86000
   41    44    47    70.00000  120.44500
   41    44    59    70.00000  120.44500
   44    47    48    35.00000  120.00000
   44    47    52    63.00000  120.00000
   44    59    55    63.00000  120.00000
   44    59    60    35.00000  120.00000
   47    52    53    35.00000  120.00000
   47    52    54    63.00000  120.00000
   52    47    48    35.00000  120.00000
   52    54    55    63.00000  120.00000
   52    54    57    70.00000  120.00000
   54    52    53    35.00000  120.00000
   54    55    56    35.00000  120.00000
   54    55    59    63.00000  120.00000
   54    57    58    35.00000  113.00000
   55    59    60    35.00000  120.00000
   59    44    47    63.00000  120.00000
   59    55    56    35.00000  120.00000
   57    54    55    70.00000  120.00000
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   0.01700  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  -0.62250  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    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   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   0.42700  1.0 1.0
   29    33    38    39  -0.70350 -1.0 2.0
   29    33    38    39  -0.43150  1.0 3.0
   29    33    38    41   0.00000  1.0 1.0
   29    33    49    45   0.56750  1.0 1.0
   29    33    49    45  -0.07550 -1.0 2.0
   29    33    49    45   0.20000  1.0 3.0
   29    33    49    50   0.56750  1.0 1.0
   29    33    49    50  -0.07550 -1.0 2.0
   29    33    49    50   0.20000  1.0 3.0
   29    33    49    51   0.15000  1.0 3.0
   33    38    39    40   0.00000  1.0 1.0
   33    38    39    42   0.69550 -1.0 2.0
   33    38    41    44   6.00000 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    49    45  -0.11250  1.0 3.0
   34    33    49    50   0.27000  1.0 3.0
   34    33    49    51   0.15000  1.0 3.0
   38    33    49    45  -0.98800  1.0 1.0
   38    33    49    45   0.48800 -1.0 2.0
   38    33    49    45   0.76800  1.0 3.0
   38    33    49    50   0.56750  1.0 1.0
   38    33    49    50  -0.07550 -1.0 2.0
   38    33    49    50   0.20000  1.0 3.0
   38    33    49    51   0.15000  1.0 3.0
   38    39    42    43   7.00000 -1.0 2.0
   38    39   -42    45   7.00000 -1.0 2.0
   38    41    44    47   1.25000 -1.0 2.0
   38    41    44    59   1.25000 -1.0 2.0
   39    38    41    44   6.00000 -1.0 2.0
   39    42    45    46   1.00000 -1.0 2.0
   39    42    45    49  -0.33500  1.0 1.0
   39    42    45    49   1.06600 -1.0 2.0
   39    42    45    49  -0.14000  1.0 3.0
   40    39    42    43   7.00000 -1.0 2.0
   40    39    42    45   7.00000 -1.0 2.0
   42    45   -49    33   0.65300  1.0 1.0
   42    45   -49    33  -0.03850 -1.0 2.0
   42    45   -49    33   0.33900  1.0 3.0
   42    45    49    50   0.65300  1.0 1.0
   42    45    49    50  -0.03850 -1.0 2.0
   42    45    49    50   0.33900  1.0 3.0
   42    45    49    51   0.00000  1.0 1.0
   43    42    45    46  -0.52200  1.0 1.0
   43    42    45    46   0.82950 -1.0 2.0
   43    42    45    49   1.50000 -1.0 2.0
   46    45    49    33   0.30150 -1.0 2.0
   46    45    49    50   0.30150 -1.0 2.0
   46    45    49    51   0.00000  1.0 1.0
   49    33   -38    39   0.09850  1.0 1.0
   49    33   -38    39   0.15250 -1.0 2.0
   49    33   -38    39  -0.50650  1.0 3.0
   49    33    38    41   0.00000  1.0 1.0
   41    38    39    40   1.00600 -1.0 2.0
   41    38    39    42   1.09650  1.0 1.0
   41    38    39    42   0.48950 -1.0 2.0
   41    38    39    42   0.49400  1.0 3.0
   41    44    47    48   3.62500 -1.0 2.0
   41    44    47    52   3.62500 -1.0 2.0
   41    44    59    55   3.62500 -1.0 2.0
   41    44    59    60   3.62500 -1.0 2.0
   44    47    52    53   3.62500 -1.0 2.0
   44    47    52    54   3.62500 -1.0 2.0
   47    44    59    55   3.62500 -1.0 2.0
   47    44    59    60   3.62500 -1.0 2.0
   47    52   -54    55   3.62500 -1.0 2.0
   47    52    54    57   3.62500 -1.0 2.0
   48    47    52    53   3.62500 -1.0 2.0
   48    47    52    54   3.62500 -1.0 2.0
   52    54    55    56   3.62500 -1.0 2.0
   52    54    55    59   3.62500 -1.0 2.0
   52    54    57    58   0.84100 -1.0 2.0
   53    52    54    55   3.62500 -1.0 2.0
   53    52    54    57   3.62500 -1.0 2.0
   54    55   -59    44   3.62500 -1.0 2.0
   54    55    59    60   3.62500 -1.0 2.0
   55    54    57    58   0.84100 -1.0 2.0
   56    55    59    44   3.62500 -1.0 2.0
   56    55    59    60   3.62500 -1.0 2.0
   59    44    47    48   3.62500 -1.0 2.0
   59    44   -47    52   3.62500 -1.0 2.0
   57    54    55    56   3.62500 -1.0 2.0
   57    54    55    59   3.62500 -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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    41  10.50000 -1.0 2.0
   38    40    39    42   1.10000 -1.0 2.0
   45    43    42    39   1.10000 -1.0 2.0
   42    49    45    46  10.50000 -1.0 2.0
   47    59    44    41   4.00000 -1.0 2.0
   52    48    47    44   1.10000 -1.0 2.0
   54    53    52    47   1.10000 -1.0 2.0
   55    57    54    52   4.00000 -1.0 2.0
   59    56    55    54   1.10000 -1.0 2.0
   55    60    59    44   1.10000 -1.0 2.0
END
