* LIGAND DATABASE FILE (OPLS2005)
*
001      60    61    115    182     338
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02035   106.26867   -22.95294
    3     1 S   H    _H1_     3     1.02025    61.29742    79.83408
    4     1 S   H    _H2_     4     1.02114    50.98855  -124.06385
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08610   110.54789    58.81774
   26    24 S   HC   HB22    34     1.08641   109.88695   179.08657
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C8_    36     1.82475    98.06479   161.84726
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CT   _C7_    37     1.61656   112.75474   -80.01526
   38    37 S   CM   _C4_    38     1.53823    98.58759  -157.86989
   39    37 S   CT   _C12    53     1.54588   117.79179    84.57223
   40    39 S   HC   _H21    54     1.08313   108.92093   -68.50821
   41    39 S   HC   _H22    55     1.08263   108.87901   171.49673
   42    39 S   HC   _H23    56     1.08251   108.89009    51.49749
   43    37 S   CT   _C13    57     1.55862   115.14686   -36.21623
   44    43 S   HC   _H24    58     1.07793   108.25435    67.15326
   45    43 S   HC   _H25    59     1.07856   108.20704   -52.84699
   46    43 S   HC   _H26    60     1.07865   108.23700  -172.80473
   47    38 S   CT   _C6_    39     1.55022   108.48639    -1.29210
   48    47 S   Cl   CL12    40     1.77504   113.33485   160.54260
   49    38 S   CM   _C5_    50     1.34276   124.48629   177.44036
   50    49 S   HC   _H19    51     1.07992   120.33297     1.46714
   51    49 S   HC   _H20    52     1.07990   120.39907  -178.54707
   52    33 S   CT   _C9_    41     1.60633   113.90770   164.76243
   53    52 S   Cl   CL13    42     1.80721   118.18025    62.20381
   54    52 S   Cl   CL14    43     1.79583   117.92640   -60.42207
   55    47 S   CT   _C10    44     1.59225   108.94857   -70.60626
   56    55 S   Cl   CL15    45     1.81523   113.06940   -49.74828
   57    55 S   Cl   CL16    46     1.81394   110.58589  -164.03845
   58    33 S   CT   _C11    47     1.61955   114.01307    49.70930
   59    58 S   Cl   CL17    48     1.80474   116.40108   -70.96876
   60    58 S   Cl   CL18    49     1.84923   112.05312    40.98318
  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  13   5   4   3
  22   2   1   1  21  20  11   3   2   1   7   2   1   1  13   8
   4   1   1   8   3   2   5   4   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    52    58    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    47    52    53    54    55    58    59    60    39    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    47    48    52    53    54    55    56    57    58    59    60    49    39    40    41    42    43    44    45    46  
   35    36  
   36  
    0  
   38    47    48    52    53    54    55    58    59    60    49    50    51    39    40    41    42    43    44    45    46  
   47    48    52    53    54    55    56    57    58    49    50    51    39    40    41    42    43    44    45    46  
   40    41    42    43    44    45    46    47    49    52    58  
   41    42    43  
   42    43  
   43  
   44    45    46    47    49    52    58  
   45    46  
   46  
    0  
   48    52    53    54    55    56    57    58    59    60    49    50    51  
   52    53    54    55    56    57    58    49  
   50    51    52    55  
   51  
    0  
   53    54    55    56    57    58    59    60  
   54    55    58  
   55    58  
   56    57    58    59    60  
   57    58    59    60  
   58    59    60  
   59    60  
   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   0.424700   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   49   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.143000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   54   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   55   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   56   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   57   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   58   3.5000   0.0660   0.143000   1.9750   1.7500   0.005000000  -0.741685710
   59   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   60   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
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   268.000  1.529
   33    52   268.000  1.529
   33    58   268.000  1.529
   37    38   317.000  1.510
   37    39   268.000  1.529
   37    43   268.000  1.529
   38    47   317.000  1.510
   38    49   549.000  1.340
   47    48   245.000  1.781
   47    52   268.000  1.529
   47    55   268.000  1.529
   52    53   245.000  1.781
   52    54   245.000  1.781
   55    56   245.000  1.781
   55    57   245.000  1.781
   55    58   268.000  1.529
   58    59   245.000  1.781
   58    60   245.000  1.781
   49    50   340.000  1.080
   49    51   340.000  1.080
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
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  111.63000
   29    33    52    75.00000  111.63000
   29    33    58    75.00000  111.63000
   33    37    38    70.00000  112.02700
   33    37    39    58.35000  112.70000
   33    37    43    58.35000  112.70000
   33    52    47    58.35000  112.70000
   33    52    53    69.00000  109.80000
   33    52    54    69.00000  109.80000
   33    58    55    58.35000  112.70000
   33    58    59    69.00000  109.80000
   33    58    60    69.00000  109.80000
   37    38    47    65.00000  117.92700
   37    38    49    70.00000  124.00000
   37    39    40    37.50000  110.70000
   37    39    41    37.50000  110.70000
   37    39    42    37.50000  110.70000
   37    43    44    37.50000  110.70000
   37    43    45    37.50000  110.70000
   37    43    46    37.50000  110.70000
   38    47    48    75.00000  111.90500
   38    47    52    70.00000  112.02700
   38    47    55    70.00000  112.02700
   38    49    50    35.00000  120.00000
   38    49    51    35.00000  120.00000
   47    52    53    69.00000  109.80000
   47    52    54    69.00000  109.80000
   47    55    56    69.00000  109.80000
   47    55    57    69.00000  109.80000
   47    55    58    58.35000  112.70000
   52    33    37    58.35000  112.70000
   52    47    48    69.00000  109.80000
   54    52    53    80.00000  110.42200
   55    47    48    69.00000  109.80000
   55    47    52    58.35000  112.70000
   55    58    59    69.00000  109.80000
   55    58    60    69.00000  109.80000
   57    55    56    80.00000  110.42200
   58    33    37    58.35000  112.70000
   58    33    52    58.35000  112.70000
   58    55    56    69.00000  109.80000
   58    55    57    69.00000  109.80000
   60    58    59    80.00000  110.42200
   49    38    47    70.00000  124.00000
   51    49    50    35.00000  117.00000
   39    37    38    70.00000  112.02700
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    33.00000  107.80000
   43    37    38    70.00000  112.02700
   43    37    39    58.35000  112.70000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    52   0.01700  1.0 1.0
   24    29    33    52  -0.23550 -1.0 2.0
   24    29    33    52   0.21350  1.0 3.0
   24    29    33    58   0.01700  1.0 1.0
   24    29    33    58  -0.23550 -1.0 2.0
   24    29    33    58   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   0.56750  1.0 1.0
   29    33    37    38  -0.07550 -1.0 2.0
   29    33    37    38   0.20000  1.0 3.0
   29    33    37    39   0.44750  1.0 1.0
   29    33    37    39  -0.17800 -1.0 2.0
   29    33    37    39   0.20200  1.0 3.0
   29    33    37    43   0.44750  1.0 1.0
   29    33    37    43  -0.17800 -1.0 2.0
   29    33    37    43   0.20200  1.0 3.0
   29    33    52    47   0.44750  1.0 1.0
   29    33    52    47  -0.17800 -1.0 2.0
   29    33    52    47   0.20200  1.0 3.0
   29    33    52    53   0.56750  1.0 1.0
   29    33    52    53  -0.07550 -1.0 2.0
   29    33    52    53   0.20000  1.0 3.0
   29    33    52    54   0.56750  1.0 1.0
   29    33    52    54  -0.07550 -1.0 2.0
   29    33    52    54   0.20000  1.0 3.0
   29    33    58    55   0.44750  1.0 1.0
   29    33    58    55  -0.17800 -1.0 2.0
   29    33    58    55   0.20200  1.0 3.0
   29    33    58    59   0.56750  1.0 1.0
   29    33    58    59  -0.07550 -1.0 2.0
   29    33    58    59   0.20000  1.0 3.0
   29    33    58    60   0.56750  1.0 1.0
   29    33    58    60  -0.07550 -1.0 2.0
   29    33    58    60   0.20000  1.0 3.0
   33    37   -38    47   0.46850  1.0 1.0
   33    37   -38    47   0.08550 -1.0 2.0
   33    37   -38    47   0.09800  1.0 3.0
   33    37    38    49   0.09850  1.0 1.0
   33    37    38    49   0.15250 -1.0 2.0
   33    37    38    49  -0.50650  1.0 3.0
   33    37    39    40   0.15000  1.0 3.0
   33    37    39    41   0.15000  1.0 3.0
   33    37    39    42   0.15000  1.0 3.0
   33    37    43    44   0.15000  1.0 3.0
   33    37    43    45   0.15000  1.0 3.0
   33    37    43    46   0.15000  1.0 3.0
   37    33   -52    47   0.56750  1.0 1.0
   37    33   -52    47  -0.07550 -1.0 2.0
   37    33   -52    47   0.20000  1.0 3.0
   37    33    52    53   0.35600  1.0 1.0
   37    33    52    53  -0.14650 -1.0 2.0
   37    33    52    53   0.33350  1.0 3.0
   37    33    52    54   0.35600  1.0 1.0
   37    33    52    54  -0.14650 -1.0 2.0
   37    33    52    54   0.33350  1.0 3.0
   37    33    58    55   0.56750  1.0 1.0
   37    33    58    55  -0.07550 -1.0 2.0
   37    33    58    55   0.20000  1.0 3.0
   37    33    58    59   0.35600  1.0 1.0
   37    33    58    59  -0.14650 -1.0 2.0
   37    33    58    59   0.33350  1.0 3.0
   37    33    58    60   0.35600  1.0 1.0
   37    33    58    60  -0.14650 -1.0 2.0
   37    33    58    60   0.33350  1.0 3.0
   37    38    47    48   0.09700  1.0 1.0
   37    38    47    48   0.15600 -1.0 2.0
   37    38    47    48  -0.50800  1.0 3.0
   37    38   -47    52   0.46850  1.0 1.0
   37    38   -47    52   0.08550 -1.0 2.0
   37    38   -47    52   0.09800  1.0 3.0
   37    38   -47    55   0.46850  1.0 1.0
   37    38   -47    55   0.08550 -1.0 2.0
   37    38   -47    55   0.09800  1.0 3.0
   37    38    49    50   7.00000 -1.0 2.0
   37    38    49    51   7.00000 -1.0 2.0
   38    37    39    40   0.15000  1.0 3.0
   38    37    39    41   0.15000  1.0 3.0
   38    37    39    42   0.15000  1.0 3.0
   38    37    43    44   0.15000  1.0 3.0
   38    37    43    45   0.15000  1.0 3.0
   38    37    43    46   0.15000  1.0 3.0
   38    47   -52    33   0.34400  1.0 1.0
   38    47   -52    33   0.09450 -1.0 2.0
   38    47   -52    33   0.11100  1.0 3.0
   38    47    52    53   0.56750  1.0 1.0
   38    47    52    53  -0.07550 -1.0 2.0
   38    47    52    53   0.20000  1.0 3.0
   38    47    52    54   0.56750  1.0 1.0
   38    47    52    54  -0.07550 -1.0 2.0
   38    47    52    54   0.20000  1.0 3.0
   38    47    55    56   0.56750  1.0 1.0
   38    47    55    56  -0.07550 -1.0 2.0
   38    47    55    56   0.20000  1.0 3.0
   38    47    55    57   0.56750  1.0 1.0
   38    47    55    57  -0.07550 -1.0 2.0
   38    47    55    57   0.20000  1.0 3.0
   38    47    55    58   0.34400  1.0 1.0
   38    47    55    58   0.09450 -1.0 2.0
   38    47    55    58   0.11100  1.0 3.0
   47    38    49    50   7.00000 -1.0 2.0
   47    38    49    51   7.00000 -1.0 2.0
   47    55   -58    33   0.56750  1.0 1.0
   47    55   -58    33  -0.07550 -1.0 2.0
   47    55   -58    33   0.20000  1.0 3.0
   47    55    58    59   0.35600  1.0 1.0
   47    55    58    59  -0.14650 -1.0 2.0
   47    55    58    59   0.33350  1.0 3.0
   47    55    58    60   0.35600  1.0 1.0
   47    55    58    60  -0.14650 -1.0 2.0
   47    55    58    60   0.33350  1.0 3.0
   48    47    52    33   0.35600  1.0 1.0
   48    47    52    33  -0.14650 -1.0 2.0
   48    47    52    33   0.33350  1.0 3.0
   48    47    52    53   0.22500  1.0 1.0
   48    47    52    54   0.22500  1.0 1.0
   48    47    55    56   0.22500  1.0 1.0
   48    47    55    57   0.22500  1.0 1.0
   48    47    55    58   0.35600  1.0 1.0
   48    47    55    58  -0.14650 -1.0 2.0
   48    47    55    58   0.33350  1.0 3.0
   52    33   -37    38   0.34400  1.0 1.0
   52    33   -37    38   0.09450 -1.0 2.0
   52    33   -37    38   0.11100  1.0 3.0
   52    33    37    39   0.56750  1.0 1.0
   52    33    37    39  -0.07550 -1.0 2.0
   52    33    37    39   0.20000  1.0 3.0
   52    33    37    43   0.56750  1.0 1.0
   52    33    37    43  -0.07550 -1.0 2.0
   52    33    37    43   0.20000  1.0 3.0
   52    33   -58    55   0.56750  1.0 1.0
   52    33   -58    55  -0.07550 -1.0 2.0
   52    33   -58    55   0.20000  1.0 3.0
   52    33    58    59   0.35600  1.0 1.0
   52    33    58    59  -0.14650 -1.0 2.0
   52    33    58    59   0.33350  1.0 3.0
   52    33    58    60   0.35600  1.0 1.0
   52    33    58    60  -0.14650 -1.0 2.0
   52    33    58    60   0.33350  1.0 3.0
   52    47    55    56   0.35600  1.0 1.0
   52    47    55    56  -0.14650 -1.0 2.0
   52    47    55    56   0.33350  1.0 3.0
   52    47    55    57   0.35600  1.0 1.0
   52    47    55    57  -0.14650 -1.0 2.0
   52    47    55    57   0.33350  1.0 3.0
   52    47   -55    58   0.56750  1.0 1.0
   52    47   -55    58  -0.07550 -1.0 2.0
   52    47   -55    58   0.20000  1.0 3.0
   55    47   -52    33   0.56750  1.0 1.0
   55    47   -52    33  -0.07550 -1.0 2.0
   55    47   -52    33   0.20000  1.0 3.0
   55    47    52    53   0.35600  1.0 1.0
   55    47    52    53  -0.14650 -1.0 2.0
   55    47    52    53   0.33350  1.0 3.0
   55    47    52    54   0.35600  1.0 1.0
   55    47    52    54  -0.14650 -1.0 2.0
   55    47    52    54   0.33350  1.0 3.0
   56    55    58    33   0.35600  1.0 1.0
   56    55    58    33  -0.14650 -1.0 2.0
   56    55    58    33   0.33350  1.0 3.0
   56    55    58    59   0.22500  1.0 1.0
   56    55    58    60   0.22500  1.0 1.0
   57    55    58    33   0.35600  1.0 1.0
   57    55    58    33  -0.14650 -1.0 2.0
   57    55    58    33   0.33350  1.0 3.0
   57    55    58    59   0.22500  1.0 1.0
   57    55    58    60   0.22500  1.0 1.0
   58    33   -37    38   0.34400  1.0 1.0
   58    33   -37    38   0.09450 -1.0 2.0
   58    33   -37    38   0.11100  1.0 3.0
   58    33    37    39   0.56750  1.0 1.0
   58    33    37    39  -0.07550 -1.0 2.0
   58    33    37    39   0.20000  1.0 3.0
   58    33    37    43   0.56750  1.0 1.0
   58    33    37    43  -0.07550 -1.0 2.0
   58    33    37    43   0.20000  1.0 3.0
   58    33   -52    47   0.56750  1.0 1.0
   58    33   -52    47  -0.07550 -1.0 2.0
   58    33   -52    47   0.20000  1.0 3.0
   58    33    52    53   0.35600  1.0 1.0
   58    33    52    53  -0.14650 -1.0 2.0
   58    33    52    53   0.33350  1.0 3.0
   58    33    52    54   0.35600  1.0 1.0
   58    33    52    54  -0.14650 -1.0 2.0
   58    33    52    54   0.33350  1.0 3.0
   49    38    47    48   0.09700  1.0 1.0
   49    38    47    48   0.15600 -1.0 2.0
   49    38    47    48  -0.50800  1.0 3.0
   49    38    47    52   0.09850  1.0 1.0
   49    38    47    52   0.15250 -1.0 2.0
   49    38    47    52  -0.50650  1.0 3.0
   49    38    47    55   0.09850  1.0 1.0
   49    38    47    55   0.15250 -1.0 2.0
   49    38    47    55  -0.50650  1.0 3.0
   39    37    38    47   0.46850  1.0 1.0
   39    37    38    47   0.08550 -1.0 2.0
   39    37    38    47   0.09800  1.0 3.0
   39    37    38    49   0.09850  1.0 1.0
   39    37    38    49   0.15250 -1.0 2.0
   39    37    38    49  -0.50650  1.0 3.0
   39    37    43    44   0.15000  1.0 3.0
   39    37    43    45   0.15000  1.0 3.0
   39    37    43    46   0.15000  1.0 3.0
   43    37    38    47   0.46850  1.0 1.0
   43    37    38    47   0.08550 -1.0 2.0
   43    37    38    47   0.09800  1.0 3.0
   43    37    38    49   0.09850  1.0 1.0
   43    37    38    49   0.15250 -1.0 2.0
   43    37    38    49  -0.50650  1.0 3.0
   43    37    39    40   0.15000  1.0 3.0
   43    37    39    41   0.15000  1.0 3.0
   43    37    39    42   0.15000  1.0 3.0
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
   36    30    34    35  10.50000 -1.0 2.0
   37    47    38    49   1.10000 -1.0 2.0
   50    51    49    38   1.10000 -1.0 2.0
END
