* LIGAND DATABASE FILE (OPLS2005)
*
001      61    61    102    157     300
    1     0 S   NP   _N1_     1    28.38121    96.30826   -20.68603
    2     1 S   H    _HN1     2     1.02837    42.41249   132.21080
    3     1 S   H    _H1_     3     1.02774    89.05450  -109.48196
    4     1 S   H    _H2_     4     1.02959    77.88049    -0.46814
    5     1 S   CT   _CA1     5     1.50072   151.69984   110.16578
    6     5 S   HC   _HA1     6     1.09588   105.24692    74.73899
    7     5 S   CO3  _C1_     7     1.53702   112.60623   -45.49397
    8     7 S   O2Z  _O11     8     1.26352   115.01556   -40.05357
    9     7 S   O2Z  _O12     9     1.26204   114.85506   139.29291
   10     5 S   CT   _CB1    10     1.53087   107.50626  -167.23697
   11    10 S   HC   HB11    11     1.09820   109.23532   -50.87879
   12    10 S   HC   HB12    12     1.09811   110.49587    65.70839
   13    10 S   CT   _CG1    13     1.52957   112.58984  -171.97077
   14    13 S   HC   HG11    14     1.09594   110.61276   -65.85555
   15    13 S   HC   HG12    15     1.09581   109.70772    53.34650
   16    13 S   C    _CD1    16     1.51737   112.50056   173.36664
   17    16 S   O    _OE1    17     1.22726   123.41201    -1.12448
   18    16 S   N    _N2_    18     1.38469   111.55048   179.35959
   19    18 S   H    _HN2    19     1.01569   119.08547     2.22721
   20    18 S   CT1  _CA2    20     1.45758   123.04173   176.52019
   21    20 S   HC   _HA2    21     1.09735   108.88058    26.62356
   22    20 S   C    _C2_    22     1.52975   107.06245   -90.23567
   23    22 S   O    _O2_    23     1.22954   123.02448   -25.29524
   24    20 S   CT   _CB2    32     1.53069   111.82053   149.85577
   25    24 S   HC   HB21    33     1.09565   110.22657    53.84711
   26    24 S   HC   HB22    34     1.09523   110.71794   172.05127
   27    22 S   N    _N3_    24     1.38611   112.43387   157.03230
   28    27 S   H    _HN3    25     1.01511   119.75942     1.55532
   29    24 S   S    _SG2    35     1.82854   110.83684   -69.08679
   30    27 S   CT   _CA3    26     1.45453   122.76306   176.56151
   31    30 S   HC   HA31    27     1.09541   108.93793    31.55627
   32    30 S   HC   HA32    28     1.09484   107.24826   148.58110
   33    29 S   CT   _C11    36     1.83857    99.92051   132.77810
   34    33 S   HC   _H3_    37     1.09406   105.61317    43.22345
   35    30 S   CO3  _C3_    29     1.52968   113.21545   -91.61461
   36    35 S   O2Z  _O31    30     1.26393   115.48052   -42.19021
   37    35 S   O2Z  _O32    31     1.26361   114.93433   138.63028
   38    33 S   CM   _C10    38     1.50670   109.70966   -77.02885
   39    38 S   HC   _H5_    39     1.08975   116.83631   -35.46941
   40    33 S   CM   _C12    57     1.50145   108.49671   161.67798
   41    40 S   HC   _H6_    58     1.09053   118.06631    45.93292
   42    38 S   CM   _C9_    40     1.34509   125.01104   144.18091
   43    40 S   CMA  _C13    59     1.51714   122.07968  -138.09515
   44    43 S   OM   _O35    60     1.26180   119.45963   173.70287
   45    43 S   OM   _O36    61     1.26255   122.07193    -6.80824
   46    42 S   C    _C8_    41     1.49082   117.56822  -178.59905
   47    46 S   O    _O34    42     1.23072   118.31215   -93.52815
   48    42 S   OH   _O37    55     1.37440   125.50115     4.64292
   49    48 S   HO   _H7_    56     0.97599   108.45398    14.53295
   50    46 S   N    _N4_    43     1.40347   115.87334    87.28397
   51    50 S   C    _C7_    44     1.39889   121.38193  -179.45751
   52    51 S   O    _O33    45     1.23181   124.22226    -2.40061
   53    51 S   CM   _C6_    46     1.49052   116.49684   178.12487
   54    53 S   Cl   Cl1_    47     1.73024   116.87125  -177.28228
   55    53 S   CM   _C5_    48     1.33540   122.02022     2.88527
   56    55 S   CHZ  _C4_    49     1.47083   114.03896    -0.47888
   57    56 S   HC   _H4_    50     1.10246   115.51951   178.58778
   58    55 S   NE   _N6_    52     1.36140   128.61758   179.91377
   59    58 S   H    _H8_    53     1.01282   120.61252   179.10671
   60    58 S   H    _H9_    54     1.01300   119.57039    -0.33920
   61    50 S   NI   _N5_    51     1.37423   116.56370     1.81575
  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
  11   6   2   1   1  10   4   5   3   7   2   1   1   9   4   2
   1   8   7   4   8   3   6   5   2   3   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    40    41    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    46    48    40    41    43    44    45  
   38    39    42    40    41    43  
   36    37  
   37  
    0  
   39    42    46    47    50    48    49    40    41    43  
   42    46    48    40  
   41    43    44    45    42  
   43    44    45  
   46    47    50    51    61    48    49  
   44    45  
   45  
    0  
   47    50    51    52    53    56    61    48    49  
   50    51    61    48  
   49    50  
    0  
   51    52    53    54    55    56    57    61  
   52    53    54    55    56    61    58  
   53    54    55    61  
   54    55    56    57    61    58    59    60  
   55    56    58  
   56    57    61    58    59    60  
   57    61    58    59    60  
   61    58  
   59    60    61  
   60  
    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   3.5500   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  -0.716200   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   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   45   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   46   3.7500   0.1050   0.570500   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   48   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   50   3.2500   0.1700  -0.125000   1.8100   1.6000   0.054801302  -1.445846770
   51   3.7500   0.1050   0.570500   1.9250   1.7000   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   53   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   55   3.5500   0.0760  -0.161700   2.0020   1.7750   0.023028004  -0.852763146
   56   3.7500   0.1050   0.387900   2.0020   1.7750   0.023028004  -0.852763146
   57   2.4200   0.0300   0.068500   1.4250   1.2500   0.008598240   0.268726247
   58   3.2500   0.1700  -0.725400   1.8650   1.6500   0.051222218  -2.220205820
   59   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   60   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   61   3.2800   0.1700  -0.276700   1.8540   1.6400   0.005000000   0.000000000
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   317.000  1.510
   33    40   317.000  1.510
   38    39   340.000  1.080
   38    42   549.000  1.340
   42    46   410.000  1.444
   42    48   510.000  1.338
   46    47   570.000  1.229
   46    50   490.000  1.335
   50    51   490.000  1.335
   50    61   305.000  1.341
   51    52   570.000  1.229
   51    53   410.000  1.444
   53    54   300.000  1.725
   53    55   549.000  1.340
   55    56   360.000  1.437
   55    58   425.000  1.378
   56    57   375.000  1.090
   56    61   645.000  1.280
   58    59   434.000  1.010
   58    60   434.000  1.010
   48    49   553.000  0.945
   40    41   340.000  1.080
   40    43   465.000  1.376
   43    44   745.000  1.250
   43    45   745.000  1.250
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  112.20000
   29    33    40    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    42    70.00000  124.00000
   33    40    41    35.00000  117.00000
   33    40    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    42    46    70.00000  118.70000
   38    42    48    80.00000  121.38400
   42    38    39    35.00000  120.00000
   42    46    47    80.00000  125.30000
   42    46    50    80.00000  111.56200
   42    48    49    70.00000  107.45700
   46    50    51    70.00000  121.37400
   46    50    61    75.00000  121.16600
   50    46    47    80.00000  122.90000
   50    51    52    80.00000  122.90000
   50    51    53    80.00000  111.56200
   50    61    56    85.00000  114.80200
   51    53    54    70.00000  120.00000
   51    53    55    70.00000  118.70000
   53    51    52    80.00000  125.30000
   53    55    56    70.00000  117.49700
   53    55    58    70.00000  124.03900
   55    53    54    75.00000  121.50000
   55    56    57    40.00000  113.81000
   55    56    61    65.00000  123.49500
   55    58    59    35.00000  114.50000
   55    58    60    35.00000  114.50000
   61    50    51    75.00000  121.16600
   61    56    57    45.00000  120.68700
   58    55    56    70.00000  124.03900
   60    58    59    35.00000  109.00000
   48    42    46    80.00000  119.00000
   40    33    34    35.00000  109.50000
   40    33    38    70.00000  110.12100
   40    43    44    65.00000  137.10300
   40    43    45    65.00000  137.10300
   43    40    41    40.00000  120.50800
   45    43    44    65.00000  121.00000
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    40  -0.62250  1.0 1.0
   24    29    33    40  -0.38450 -1.0 2.0
   24    29    33    40   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    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    40    41   0.00000  1.0 1.0
   29    33    40    43   0.42700  1.0 1.0
   29    33    40    43  -0.70350 -1.0 2.0
   29    33    40    43  -0.43150  1.0 3.0
   33    38    42    46   7.00000 -1.0 2.0
   33    38    42    48   7.00000 -1.0 2.0
   33    40    43    44   7.00000 -1.0 2.0
   33    40    43    45   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    40    41   0.33100  1.0 3.0
   34    33    40    43   0.00000  1.0 1.0
   38    33    40    41   0.00000  1.0 1.0
   38    33    40    43  -0.28300  1.0 1.0
   38    33    40    43   0.26700 -1.0 2.0
   38    33    40    43  -0.63300  1.0 3.0
   38    42    46    47   1.00000 -1.0 2.0
   38    42    46    50   0.49500  1.0 1.0
   38    42    46    50   1.31600 -1.0 2.0
   38    42    46    50  -0.02300  1.0 3.0
   38    42    48    49  -0.66100  1.0 1.0
   38    42    48    49   1.20850 -1.0 2.0
   38    42    48    49  -0.36000  1.0 3.0
   39    38    42    46   7.00000 -1.0 2.0
   39    38    42    48   7.00000 -1.0 2.0
   42    46    50    51   2.45000 -1.0 2.0
   42    46    50    61   2.45000 -1.0 2.0
   46    42    48    49   2.00000 -1.0 2.0
   46    50    51    52   2.22250 -1.0 2.0
   46    50    51    53   2.45000 -1.0 2.0
   46    50    61    56   1.42450 -1.0 2.0
   47    46    50    51   2.22250 -1.0 2.0
   47    46    50    61  -0.75150  1.0 1.0
   47    46    50    61   0.83450 -1.0 2.0
   50    51    53    54   1.50000 -1.0 2.0
   50    51    53    55   0.49500  1.0 1.0
   50    51    53    55   1.31600 -1.0 2.0
   50    51    53    55  -0.02300  1.0 3.0
   51    50    61    56   1.42450 -1.0 2.0
   51    53   -55    56   7.00000 -1.0 2.0
   51    53    55    58   7.00000 -1.0 2.0
   52    51    53    54  -0.52200  1.0 1.0
   52    51    53    54   0.82950 -1.0 2.0
   52    51    53    55   1.00000 -1.0 2.0
   53    55    56    57   1.36050 -1.0 2.0
   53    55    56    61   1.09650  1.0 1.0
   53    55    56    61   0.48950 -1.0 2.0
   53    55    56    61   0.49400  1.0 3.0
   53    55    58    59   1.00000 -1.0 2.0
   53    55    58    60   1.00000 -1.0 2.0
   54    53    55    56   7.00000 -1.0 2.0
   54    53    55    58   7.00000 -1.0 2.0
   55    56   -61    50   6.00000 -1.0 2.0
   56    55    58    59   1.00000 -1.0 2.0
   56    55    58    60   1.00000 -1.0 2.0
   57    56    61    50   4.00000 -1.0 2.0
   61    50    51    52  -0.75150  1.0 1.0
   61    50    51    52   0.83450 -1.0 2.0
   61    50   -51    53   2.45000 -1.0 2.0
   58    55    56    57   7.00000 -1.0 2.0
   58    55    56    61   7.00000 -1.0 2.0
   48    42    46    47  -0.11900  1.0 1.0
   48    42    46    47   0.76850 -1.0 2.0
   48    42    46    47   0.14100  1.0 3.0
   48    42    46    50   1.50000 -1.0 2.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    42  -0.28300  1.0 1.0
   40    33    38    42   0.26700 -1.0 2.0
   40    33    38    42  -0.63300  1.0 3.0
   41    40    43    44   7.00000 -1.0 2.0
   41    40    43    45   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    42  15.00000 -1.0 2.0
   46    48    42    38  15.00000 -1.0 2.0
   42    50    46    47  10.50000 -1.0 2.0
   61    46    50    51   1.00000 -1.0 2.0
   50    53    51    52  10.50000 -1.0 2.0
   51    54    53    55   1.10000 -1.0 2.0
   56    58    55    53   1.10000 -1.0 2.0
   55    57    56    61  10.50000 -1.0 2.0
   60    55    58    59   1.00000 -1.0 2.0
   33    41    40    43  15.00000 -1.0 2.0
   44    45    43    40  15.00000 -1.0 2.0
END
