* LIGAND DATABASE FILE (OPLS2005)
*
001      65    65    113    165     325
    1     0 S   NP   _N1_     1    28.66109    95.10864   -21.20242
    2     1 S   H    _HN1     2     1.02960    87.07853    27.58418
    3     1 S   H    _H1_     3     1.02837    34.27467   154.16692
    4     1 S   H    _H2_     4     1.02778    88.91200   -80.83101
    5     1 S   CT   _CA1     5     1.50115   144.96579   149.93313
    6     5 S   HC   _HA1     6     1.09575   105.23962    61.70377
    7     5 S   CO3  _C1_     7     1.53798   112.37619   -58.51658
    8     7 S   O2Z  _O11     8     1.26357   114.99674   -44.09977
    9     7 S   O2Z  _O12     9     1.26238   114.91517   135.05844
   10     5 S   CT   _CB1    10     1.53093   107.43178   179.61539
   11    10 S   HC   HB11    11     1.09822   109.35436   -50.78750
   12    10 S   HC   HB12    12     1.09821   110.41393    65.77862
   13    10 S   CT   _CG1    13     1.52991   112.64685  -171.90529
   14    13 S   HC   HG11    14     1.09571   110.38151   -62.96978
   15    13 S   HC   HG12    15     1.09647   110.03543    56.19254
   16    13 S   C    _CD1    16     1.51808   112.32285   176.48386
   17    16 S   O    _OE1    17     1.22720   123.27386    -5.02648
   18    16 S   N    _N2_    18     1.38604   111.62852   175.34773
   19    18 S   H    _HN2    19     1.01597   118.98617     0.72497
   20    18 S   CT1  _CA2    20     1.46204   123.43708  -179.59555
   21    20 S   HC   _HA2    21     1.09733   109.39021   -11.91818
   22    20 S   C    _C2_    22     1.53437   108.31664  -127.53738
   23    22 S   O    _O2_    23     1.23012   122.23082  -146.26093
   24    20 S   CT   _CB2    32     1.53337   111.41668   110.21681
   25    24 S   HC   HB21    33     1.09607   109.87240    54.92029
   26    24 S   HC   HB22    34     1.09494   110.48426   173.18327
   27    22 S   N    _N3_    24     1.38501   113.37694    41.13681
   28    27 S   H    _HN3    25     1.01527   118.90729    -0.78285
   29    24 S   S    _SG2    35     1.83126   111.66920   -66.78994
   30    27 S   CT   _CA3    26     1.45460   123.56029   175.04912
   31    30 S   HC   HA31    27     1.09514   109.37447    21.62211
   32    30 S   HC   HA32    28     1.09499   107.08779   138.65898
   33    29 S   CA   _C11    36     1.80806    98.93023   168.53741
   34    30 S   CO3  _C3_    29     1.52921   113.02040  -101.94319
   35    34 S   O2Z  _O31    30     1.26408   115.37465   -44.75759
   36    34 S   O2Z  _O32    31     1.26348   114.99983   136.14595
   37    33 S   CA   _C10    37     1.42335   121.50941    91.99841
   38    37 S   I    I2__    38     2.18476   119.01342     0.97317
   39    37 S   CA   _C9_    39     1.42559   121.88141  -179.87646
   40    39 S   CA   _C8_    40     1.41962   117.49801     1.23891
   41    40 S   I    I3__    41     2.16560   121.06671  -179.59074
   42    39 S   CT   _C13    57     1.52247   121.63680   179.78878
   43    42 S   HC   _H10    58     1.09414   110.89734    34.92995
   44    42 S   HC   _H11    59     1.09451   110.71587   146.62206
   45    40 S   CA   _C7_    42     1.41569   121.98135    -0.59807
   46    42 S   CT   _C14    60     1.52883   112.40000   -89.45844
   47    46 S   HC   _H12    61     1.09661   110.26362    58.36485
   48    46 S   HC   _H13    62     1.09668   110.20437   -58.72863
   49    33 S   CA   _C12    43     1.41512   120.15132   -88.40563
   50    49 S   I    I1__    44     2.17007   121.32650    -4.31393
   51    45 S   NI   _N5_    45     1.41409   120.65277  -179.89532
   52    46 S   CO3  _C15    63     1.53176   114.88035   179.84549
   53    52 S   O2Z  _O34    64     1.26519   114.02084   179.90935
   54    52 S   O2Z  _O33    65     1.26119   116.69948    -0.09691
   55    51 S   CDX  _C6_    46     1.29736   116.15054   -91.60450
   56    55 S   HC   _H9_    47     1.10654   120.61776     0.07662
   57    55 S   NE   _N4_    48     1.38112   127.72904   179.94405
   58    57 S   CT   _C4_    49     1.45484   121.16420  -173.54147
   59    58 S   HC   _H3_    50     1.09452   110.04472    85.80963
   60    58 S   HC   _H4_    51     1.09523   111.11612   -34.37923
   61    58 S   HC   _H5_    52     1.09496   111.31005  -153.78132
   62    57 S   CT   _C5_    53     1.45558   120.94085    -5.58690
   63    62 S   HC   _H6_    54     1.09515   110.91945    43.48259
   64    62 S   HC   _H7_    55     1.09466   110.06338   -76.77519
   65    62 S   HC   _H8_    56     1.09500   111.57352   162.94401
  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
   9   2   1   1  11   4  12  10   4   9   5   4   6   5   4   3
   3   1   5   2   1   1  10   3   8   7   3   2   1   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    49    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    45    49    50  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    45    49    50    51    42  
   35    36  
   36  
    0  
   38    39    40    41    45    49    50    42    43    44    46  
   39    40    49    42  
   40    41    45    49    51    42    43    44    46    47    48    52  
   41    45    49    50    51    55    42    43    44    46  
   45    49    51    42  
   43    44    46    47    48    52    53    54    45  
   44    46    47    48    52  
   46    47    48    52  
   49    50    51    55    56    57  
   47    48    52    53    54  
   48    52    53    54  
   52    53    54  
   50    51    55  
   51  
   55    56    57    58    62  
   53    54  
   54  
    0  
   56    57    58    59    60    61    62    63    64    65  
   57    58    62  
   58    59    60    61    62    63    64    65  
   59    60    61    62    63    64    65  
   60    61    62  
   61    62  
   62  
   63    64    65  
   64    65  
   65  
    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  -0.320000   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   0.0700   0.152500   2.5000   1.7750   0.001000000  -0.843144165
   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   0.0700   0.100000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.7500   0.6000  -0.100000   2.1120   1.8750   0.001000000  -0.848554734
   39   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700   0.100000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.7500   0.6000  -0.100000   2.1120   1.8750   0.001000000  -0.848554734
   42   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5500   0.0700   0.030800   2.0020   1.7750   0.001000000  -0.843144165
   46   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   49   3.5500   0.0700   0.100000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.7500   0.6000  -0.100000   2.1120   1.8750   0.001000000  -0.848554734
   51   3.2800   0.1700  -0.389800   1.8540   1.6400   0.005000000   0.000000000
   52   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   55   3.7500   0.1050   0.275900   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.058100   1.4250   1.2500   0.008598240   0.268726247
   57   3.2500   0.1700  -0.220000   1.9050   1.6860   0.051222218  -2.220205820
   58   3.5000   0.0660  -0.057500   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.057500   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   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   250.000  1.760
   33    37   469.000  1.400
   33    49   469.000  1.400
   37    38   268.000  2.091
   37    39   469.000  1.400
   39    40   469.000  1.400
   39    42   317.000  1.510
   40    41   268.000  2.091
   40    45   469.000  1.400
   45    49   469.000  1.400
   45    51   400.000  1.385
   49    50   268.000  2.091
   51    55   650.000  1.285
   55    56   370.000  1.091
   55    57   445.000  1.380
   57    58   382.000  1.448
   57    62   382.000  1.448
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    46   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    52   317.000  1.522
   52    53   656.000  1.250
   52    54   656.000  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    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    62.00000  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    49    85.00000  119.40000
   33    37    38    63.00000  120.00000
   33    37    39    63.00000  120.00000
   33    49    45    63.00000  120.00000
   33    49    50    63.00000  120.00000
   37    39    40    63.00000  120.00000
   37    39    42    70.00000  120.00000
   39    37    38    63.00000  120.00000
   39    40    41    63.00000  120.00000
   39    40    45    63.00000  120.00000
   39    42    43    35.00000  109.50000
   39    42    44    35.00000  109.50000
   39    42    46    70.00000  112.17500
   40    45    49    63.00000  120.00000
   40    45    51    70.00000  120.44500
   45    40    41    63.00000  120.00000
   45    49    50    63.00000  120.00000
   45    51    55    70.00000  111.79000
   49    33    37    63.00000  120.00000
   51    45    49    70.00000  120.44500
   51    55    56    45.00000  121.92500
   51    55    57    75.00000  124.36500
   55    57    58    50.00000  119.50000
   55    57    62    50.00000  119.50000
   57    55    56    50.00000  114.66700
   57    58    59    35.00000  109.50000
   57    58    60    35.00000  109.50000
   57    58    61    35.00000  109.50000
   57    62    63    35.00000  109.50000
   57    62    64    35.00000  109.50000
   57    62    65    35.00000  109.50000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   62    57    58    50.00000  115.00000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   42    39    40    70.00000  120.00000
   42    46    47    37.50000  110.70000
   42    46    48    37.50000  110.70000
   42    46    52    70.00000  109.69300
   44    42    43    33.00000  107.80000
   46    42    43    37.50000  110.70000
   46    42    44    37.50000  110.70000
   46    52    53    70.00000  117.00000
   46    52    54    70.00000  117.00000
   48    46    47    33.00000  107.80000
   52    46    47    35.00000  109.50000
   52    46    48    35.00000  109.50000
   54    52    53    80.00000  126.00000
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  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  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    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   0.63250 -1.0 2.0
   24    29    33    49   0.63250 -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   3.62500 -1.0 2.0
   29    33    37    39   3.62500 -1.0 2.0
   29    33    49    45   3.62500 -1.0 2.0
   29    33    49    50   3.62500 -1.0 2.0
   33    37    39    40   3.62500 -1.0 2.0
   33    37    39    42   3.62500 -1.0 2.0
   37    33    49    45   3.62500 -1.0 2.0
   37    33    49    50   3.62500 -1.0 2.0
   37    39    40    41   3.62500 -1.0 2.0
   37    39   -40    45   3.62500 -1.0 2.0
   37    39    42    43   0.00000  1.0 1.0
   37    39    42    44   0.00000  1.0 1.0
   37    39    42    46   0.04150 -1.0 2.0
   38    37    39    40   3.62500 -1.0 2.0
   38    37    39    42   3.62500 -1.0 2.0
   39    40    45    49   3.62500 -1.0 2.0
   39    40    45    51   3.62500 -1.0 2.0
   39    42    46    47   0.43200  1.0 3.0
   39    42    46    48   0.43200  1.0 3.0
   39    42    46    52  -2.95950  1.0 1.0
   39    42    46    52   0.02300  1.0 3.0
   40    39    42    43   0.00000  1.0 1.0
   40    39    42    44   0.00000  1.0 1.0
   40    39    42    46   0.04150 -1.0 2.0
   40    45   -49    33   3.62500 -1.0 2.0
   40    45    49    50   3.62500 -1.0 2.0
   40    45    51    55   1.25000 -1.0 2.0
   41    40    45    49   3.62500 -1.0 2.0
   41    40    45    51   3.62500 -1.0 2.0
   45    51    55    56   4.00000 -1.0 2.0
   45    51    55    57   6.00000 -1.0 2.0
   49    33    37    38   3.62500 -1.0 2.0
   49    33   -37    39   3.62500 -1.0 2.0
   49    45    51    55   1.25000 -1.0 2.0
   51    45    49    33   3.62500 -1.0 2.0
   51    45    49    50   3.62500 -1.0 2.0
   51    55    57    58  -0.86000  1.0 1.0
   51    55    57    58   0.84650 -1.0 2.0
   51    55    57    62  -0.86000  1.0 1.0
   51    55    57    62   0.84650 -1.0 2.0
   55    57    58    59   0.00000  1.0 1.0
   55    57    58    60   0.00000  1.0 1.0
   55    57    58    61   0.00000  1.0 1.0
   55    57    62    63   0.00000  1.0 1.0
   55    57    62    64   0.00000  1.0 1.0
   55    57    62    65   0.00000  1.0 1.0
   56    55    57    58   0.00000  1.0 1.0
   56    55    57    62   0.00000  1.0 1.0
   58    57    62    63   0.00000  1.0 1.0
   58    57    62    64   0.00000  1.0 1.0
   58    57    62    65   0.00000  1.0 1.0
   62    57    58    59   0.00000  1.0 1.0
   62    57    58    60   0.00000  1.0 1.0
   62    57    58    61   0.00000  1.0 1.0
   42    39    40    41   3.62500 -1.0 2.0
   42    39    40    45   3.62500 -1.0 2.0
   42    46    52    53   0.41150 -1.0 2.0
   42    46    52    54   0.41150 -1.0 2.0
   43    42    46    47   0.15000  1.0 3.0
   43    42    46    48   0.15000  1.0 3.0
   43    42    46    52  -0.11250  1.0 3.0
   44    42    46    47   0.15000  1.0 3.0
   44    42    46    48   0.15000  1.0 3.0
   44    42    46    52  -0.11250  1.0 3.0
   47    46    52    53   0.00000  1.0 1.0
   47    46    52    54   0.00000  1.0 1.0
   48    46    52    53   0.00000  1.0 1.0
   48    46    52    54   0.00000  1.0 1.0
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
   35    30    34    36  10.50000 -1.0 2.0
   37    49    33    29   4.00000 -1.0 2.0
   39    38    37    33   4.00000 -1.0 2.0
   40    42    39    37   4.00000 -1.0 2.0
   45    41    40    39   4.00000 -1.0 2.0
   49    51    45    40   4.00000 -1.0 2.0
   45    50    49    33   4.00000 -1.0 2.0
   57    56    55    51  10.50000 -1.0 2.0
   62    55    57    58   1.00000 -1.0 2.0
   53    46    52    54  10.50000 -1.0 2.0
END
