* LIGAND DATABASE FILE (OPLS2005)
*
001      63    64    110    170     327
    1     0 S   NP   _N1_     1    29.10401    96.99932   -20.62965
    2     1 S   H    _HN1     2     1.02954    45.45230   129.72718
    3     1 S   H    _H1_     3     1.02793    96.63989  -121.75206
    4     1 S   H    _H2_     4     1.02841    69.59687   -14.65423
    5     1 S   CT   _CA1     5     1.50554   148.34894    83.06746
    6     5 S   HC   _HA1     6     1.09683   104.55241    97.02106
    7     5 S   CO3  _C1_     7     1.54486   110.80941   -18.73645
    8     7 S   O2Z  _O11     8     1.26018   116.77243  -120.05802
    9     7 S   O2Z  _O12     9     1.26602   113.75956    58.53236
   10     5 S   CT   _CB1    10     1.53163   106.93213  -146.84173
   11    10 S   HC   HB11    11     1.09835   110.18497   -40.51629
   12    10 S   HC   HB12    12     1.09759   110.17997    76.24285
   13    10 S   CT   _CG1    13     1.52930   112.13591  -160.91192
   14    13 S   HC   HG11    14     1.09453   110.82415   -58.11738
   15    13 S   HC   HG12    15     1.09664   109.65593    60.89115
   16    13 S   C    _CD1    16     1.51729   112.45829  -178.15708
   17    16 S   O    _OE1    17     1.22718   123.36781     9.87141
   18    16 S   N    _N2_    18     1.38641   111.58905  -171.24806
   19    18 S   H    _HN2    19     1.01566   118.95139     4.70711
   20    18 S   CT1  _CA2    20     1.46353   123.54580  -176.12976
   21    20 S   HC   _HA2    21     1.09724   109.26240     6.27882
   22    20 S   C    _C2_    22     1.53454   109.43720  -109.89124
   23    22 S   O    _O2_    23     1.23085   122.07382  -150.57728
   24    20 S   CT   _CB2    32     1.53629   110.79200   127.80603
   25    24 S   HC   HB21    33     1.09239   108.52559    61.63055
   26    24 S   HC   HB22    34     1.09501   110.70650   179.72589
   27    22 S   N    _N3_    24     1.38260   113.91878    36.78231
   28    27 S   H    _HN3    25     1.01577   119.58640    -3.24105
   29    24 S   S    _SG2    35     1.83235   110.38372   -60.76345
   30    27 S   CT   _CA3    26     1.45287   123.19273   177.16407
   31    30 S   HC   HA31    27     1.09550   107.48042   -65.15947
   32    30 S   HC   HA32    28     1.09558   108.01114    51.27024
   33    29 S   CT   _C6_    36     1.85635   103.37459   151.68185
   34    30 S   CO3  _C3_    29     1.52953   114.11615   173.28183
   35    34 S   O2Z  _O31    30     1.26370   116.08648    -1.07411
   36    34 S   O2Z  _O32    31     1.26430   114.40984   179.00201
   37    33 S   CM   _C5_    37     1.51804   109.50203    61.91088
   38    37 S   HC   _H6_    38     1.08086   125.02530    61.18787
   39    33 S   CT   _C7_    51     1.57617   110.01439  -176.14949
   40    39 S   HC   _H3_    52     1.09829   108.83149  -174.19917
   41    37 S   CM   _C4_    39     1.34205   109.99719  -119.77190
   42    41 S   HC   _H5_    40     1.07857   125.90472  -179.56931
   43    39 S   OH   _O35    53     1.42852   110.73868   -57.37811
   44    43 S   HO   _H13    54     0.97256   107.50383  -178.92480
   45    41 S   CM   _C15    41     1.44164   110.12123     0.92408
   46    45 S   HC   _H8_    42     1.07895   123.75980   179.95577
   47    33 S   CM   _C14    43     1.53721   111.98742   -48.71602
   48    47 S   CZ   _C13    44     1.41756   124.49156   -64.16133
   49    48 S   CZ   _C12    45     1.20124   160.06250   -20.75021
   50    49 S   CM   _C11    46     1.43792   158.80522    -1.98258
   51    50 S   CM   _C10    47     1.35615   117.19645    -3.94159
   52    51 S   HC   _H7_    48     1.08481   121.40913   179.25087
   53    50 S   CT   _C16    55     1.50979   120.70723   175.49580
   54    53 S   HC   _H4_    56     1.09635   110.46856  -170.98143
   55    51 S   CZ   _C9_    49     1.43216   120.05557    -0.64619
   56    53 S   CT   _C17    57     1.53112   112.18194    67.29387
   57    56 S   HC   _H9_    58     1.09508   111.14106    50.46913
   58    56 S   HC   _H10    59     1.09519   111.56751   -71.81541
   59    53 S   OH   _O34    62     1.43109   109.53266   -54.91399
   60    59 S   HO   _H12    63     0.97204   108.14238    73.02990
   61    55 S   CZ   _C8_    50     1.20288   160.66562     0.03426
   62    56 S   OH   _O33    60     1.42466   109.17626   169.35896
   63    62 S   HO   _H11    61     0.97237   107.10571  -179.44645
  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  11   5   4   3
  15   2   1   1  11   5  10   5   5   3   4   1   4   2   4   4
   8  12   7   3   9   6   1   6   4   3   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    47    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    45    47    48    61    39    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    45    46    47    48    49    55    61    39    40    43    44  
   35    36  
   36  
    0  
   38    41    42    45    46    47    48    61    39    40    43  
   41    42    45    47    39  
   40    43    44    41    45    47    48    51    55    61  
   43    44    47    55    61  
   42    45    46    47    48  
   45    46    47  
   44    47    55    61  
   61  
   46    47    48    49  
   47    48  
   48    49    50    61  
   49    50    51    53  
   50    51    52    55    53    54    56    59  
   51    52    55    61    53    54    56    57    58    62    59    60  
   52    55    61    53    54    56    59  
   55    61    53  
   54    56    57    58    62    63    59    60    55  
   56    57    58    62    59    60  
   61  
   57    58    62    63    59    60  
   58    62    63    59  
   62    63    59  
   60    62  
    0  
    0  
   63  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   48   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   49   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   56   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   62   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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   222.000  1.810
   33    37   317.000  1.510
   33    47   317.000  1.510
   33    39   268.000  1.529
   37    38   340.000  1.080
   37    41   549.000  1.340
   41    42   340.000  1.080
   41    45   380.000  1.444
   45    46   340.000  1.080
   45    47   549.000  1.340
   47    48   400.000  1.423
   48    49   985.000  1.221
   49    50   400.000  1.423
   50    51   549.000  1.340
   50    53   317.000  1.510
   51    52   340.000  1.080
   51    55   400.000  1.423
   55    61   985.000  1.221
   61    39   390.000  1.470
   39    40   340.000  1.090
   39    43   320.000  1.410
   43    44   553.000  0.945
   53    54   340.000  1.090
   53    56   268.000  1.529
   53    59   320.000  1.410
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    62   320.000  1.410
   62    63   553.000  0.945
   59    60   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    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    37    75.00000  112.20000
   29    33    47    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    41    70.00000  124.00000
   33    47    45    70.00000  124.00000
   33    47    48    65.00000  118.62000
   33    39    61    58.35000  112.70000
   33    39    40    37.50000  110.70000
   33    39    43    50.00000  109.50000
   37    41    42    35.00000  120.00000
   37    41    45    70.00000  123.01800
   41    37    38    35.00000  120.00000
   41    45    46    35.00000  120.00000
   41    45    47    70.00000  123.01800
   45    41    42    35.00000  120.00000
   45    47    48    65.00000  121.28400
   47    33    37    70.00000  110.12100
   47    45    46    35.00000  120.00000
   47    48    49    30.00000  178.29000
   48    49    50    30.00000  178.29000
   49    50    51    65.00000  121.28400
   49    50    53    65.00000  118.62000
   50    51    52    35.00000  120.00000
   50    51    55    65.00000  121.28400
   50    53    54    35.00000  109.50000
   50    53    56    70.00000  112.02700
   50    53    59    90.00000  110.39200
   51    55    61    30.00000  178.29000
   55    51    52    40.00000  117.14900
   55    61    39    30.00000  179.48800
   61    39    40    35.00000  108.50000
   61    39    43    90.00000  111.78800
   39    33    37    70.00000  112.02700
   39    33    47    70.00000  112.02700
   39    43    44    55.00000  108.50000
   43    39    40    35.00000  109.50000
   53    50    51    70.00000  124.00000
   53    56    57    37.50000  110.70000
   53    56    58    37.50000  110.70000
   53    56    62    50.00000  109.50000
   53    59    60    55.00000  108.50000
   56    53    54    37.50000  110.70000
   56    62    63    55.00000  108.50000
   58    56    57    33.00000  107.80000
   62    56    57    35.00000  109.50000
   62    56    58    35.00000  109.50000
   59    53    54    35.00000  109.50000
   59    53    56    50.00000  109.50000
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    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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    47  -0.62250  1.0 1.0
   24    29    33    47  -0.38450 -1.0 2.0
   24    29    33    47   0.81900  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   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    37    38   0.00000  1.0 1.0
   29    33    37    41   0.42700  1.0 1.0
   29    33    37    41  -0.70350 -1.0 2.0
   29    33    37    41  -0.43150  1.0 3.0
   29    33    47    45   0.42700  1.0 1.0
   29    33    47    45  -0.70350 -1.0 2.0
   29    33    47    45  -0.43150  1.0 3.0
   29    33    47    48   0.09700  1.0 1.0
   29    33    47    48   0.15600 -1.0 2.0
   29    33    47    48  -0.50800  1.0 3.0
   29    33    39    61   0.56750  1.0 1.0
   29    33    39    61  -0.07550 -1.0 2.0
   29    33    39    61   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    37    41    42   7.00000 -1.0 2.0
   33    37   -41    45   7.00000 -1.0 2.0
   33    47    48    49   0.00000  1.0 1.0
   33    39    43    44  -0.11600  1.0 1.0
   33    39    43    44  -0.09450 -1.0 2.0
   33    39    43    44   0.21250  1.0 3.0
   37    33   -47    45  -0.28300  1.0 1.0
   37    33   -47    45   0.26700 -1.0 2.0
   37    33   -47    45  -0.63300  1.0 3.0
   37    33    47    48   0.09700  1.0 1.0
   37    33    47    48   0.15600 -1.0 2.0
   37    33    47    48  -0.50800  1.0 3.0
   37    33    39    61   0.56750  1.0 1.0
   37    33    39    61  -0.07550 -1.0 2.0
   37    33    39    61   0.20000  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    43   1.05650  1.0 1.0
   37    33    39    43   0.15600 -1.0 2.0
   37    33    39    43   0.53150  1.0 3.0
   37    41    45    46  -0.18600  1.0 3.0
   37    41   -45    47   0.28850  1.0 1.0
   37    41   -45    47   2.61350 -1.0 2.0
   37    41   -45    47   0.78400  1.0 3.0
   38    37    41    42   7.00000 -1.0 2.0
   38    37    41    45   7.00000 -1.0 2.0
   41    45   -47    33   7.00000 -1.0 2.0
   41    45    47    48   7.00000 -1.0 2.0
   42    41    45    46   0.00000  1.0 1.0
   42    41    45    47  -0.18600  1.0 3.0
   45    47    48    49   0.00000  1.0 1.0
   46    45    47    33   7.00000 -1.0 2.0
   46    45    47    48   7.00000 -1.0 2.0
   47    33    37    38   0.00000  1.0 1.0
   47    33   -37    41  -0.28300  1.0 1.0
   47    33   -37    41   0.26700 -1.0 2.0
   47    33   -37    41  -0.63300  1.0 3.0
   47    33    39    61   0.56750  1.0 1.0
   47    33    39    61  -0.07550 -1.0 2.0
   47    33    39    61   0.20000  1.0 3.0
   47    33    39    40   0.15000  1.0 3.0
   47    33    39    43   1.05650  1.0 1.0
   47    33    39    43   0.15600 -1.0 2.0
   47    33    39    43   0.53150  1.0 3.0
   47    48    49    50   0.00000  1.0 1.0
   48    49    50    51   0.00000  1.0 1.0
   48    49    50    53   0.00000  1.0 1.0
   49    50    51    52   7.00000 -1.0 2.0
   49    50    51    55   7.00000 -1.0 2.0
   49    50    53    54   0.00000  1.0 1.0
   49    50    53    56   0.09700  1.0 1.0
   49    50    53    56   0.15600 -1.0 2.0
   49    50    53    56  -0.50800  1.0 3.0
   49    50    53    59   0.09700  1.0 1.0
   49    50    53    59   0.15600 -1.0 2.0
   49    50    53    59  -0.50800  1.0 3.0
   50    51    55    61   0.00000  1.0 1.0
   50    53    56    57   0.15000  1.0 3.0
   50    53    56    58   0.15000  1.0 3.0
   50    53    56    62   1.05650  1.0 1.0
   50    53    56    62   0.15600 -1.0 2.0
   50    53    56    62   0.53150  1.0 3.0
   50    53    59    60  -0.07800  1.0 1.0
   50    53    59    60  -0.21500 -1.0 2.0
   50    53    59    60  -0.03150  1.0 3.0
   51    50    53    54   0.00000  1.0 1.0
   51    50    53    56   0.09850  1.0 1.0
   51    50    53    56   0.15250 -1.0 2.0
   51    50    53    56  -0.50650  1.0 3.0
   51    50    53    59   0.67800  1.0 1.0
   51    50    53    59   0.47050 -1.0 2.0
   51    50    53    59  -0.62500  1.0 3.0
   51    55    61    39   0.00000  1.0 1.0
   52    51    55    61   0.00000  1.0 1.0
   55    61    39    33   0.00000  1.0 1.0
   55    61    39    40   0.00000  1.0 1.0
   55    61    39    43   0.00000  1.0 1.0
   61    39    43    44   0.35600  1.0 1.0
   61    39    43    44  -0.10750 -1.0 2.0
   61    39    43    44  -0.54400  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    41   0.09850  1.0 1.0
   39    33    37    41   0.15250 -1.0 2.0
   39    33    37    41  -0.50650  1.0 3.0
   39    33    47    45   0.09850  1.0 1.0
   39    33    47    45   0.15250 -1.0 2.0
   39    33    47    45  -0.50650  1.0 3.0
   39    33    47    48   0.09700  1.0 1.0
   39    33    47    48   0.15600 -1.0 2.0
   39    33    47    48  -0.50800  1.0 3.0
   40    39    43    44   0.19450  1.0 3.0
   53    50    51    52   7.00000 -1.0 2.0
   53    50    51    55   7.00000 -1.0 2.0
   53    56    62    63  -0.11600  1.0 1.0
   53    56    62    63  -0.09450 -1.0 2.0
   53    56    62    63   0.21250  1.0 3.0
   54    53    56    57   0.15000  1.0 3.0
   54    53    56    58   0.15000  1.0 3.0
   54    53    56    62   0.23400  1.0 3.0
   54    53    59    60   0.19450  1.0 3.0
   56    53    59    60  -0.11600  1.0 1.0
   56    53    59    60  -0.09450 -1.0 2.0
   56    53    59    60   0.21250  1.0 3.0
   57    56    62    63   0.19450  1.0 3.0
   58    56    62    63   0.19450  1.0 3.0
   59    53    56    57   0.23400  1.0 3.0
   59    53    56    58   0.23400  1.0 3.0
   59    53    56    62   3.75450  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
   33    38    37    41   1.10000 -1.0 2.0
   45    42    41    37   1.10000 -1.0 2.0
   41    46    45    47   1.10000 -1.0 2.0
   33    48    47    45   1.10000 -1.0 2.0
   49    53    50    51   1.10000 -1.0 2.0
   55    52    51    50   1.10000 -1.0 2.0
END
