* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    106    148     299
    1     0 S   NP   _N1_     1    28.87511    92.85942   -23.78532
    2     1 S   H    _HN1     2     1.02962    91.48540    30.85179
    3     1 S   H    _H1_     3     1.02839    16.03525  -163.10238
    4     1 S   H    _H2_     4     1.02778   110.42965   -79.35384
    5     1 S   CT   _CA1     5     1.50123   121.53536   145.99791
    6     5 S   HC   _HA1     6     1.09576   105.22577    72.36656
    7     5 S   CO3  _C1_     7     1.53781   112.38257   -47.81967
    8     7 S   O2Z  _O11     8     1.26358   114.99709   -43.88198
    9     7 S   O2Z  _O12     9     1.26239   114.91680   135.26834
   10     5 S   CT   _CB1    10     1.53099   107.43185  -169.74721
   11    10 S   HC   HB11    11     1.09823   109.30389   -50.97242
   12    10 S   HC   HB12    12     1.09819   110.42374    65.56534
   13    10 S   CT   _CG1    13     1.53014   112.69230  -172.09096
   14    13 S   HC   HG11    14     1.09601   110.42596   -64.15179
   15    13 S   HC   HG12    15     1.09653   109.99398    55.07086
   16    13 S   C    _CD1    16     1.51824   112.32863   175.40113
   17    16 S   O    _OE1    17     1.22722   123.28199    -2.24263
   18    16 S   N    _N2_    18     1.38621   111.64494   177.94196
   19    18 S   H    _HN2    19     1.01595   118.99273     1.01124
   20    18 S   CT1  _CA2    20     1.46194   123.39990  -179.87180
   21    20 S   HC   _HA2    21     1.09728   109.44465    -9.36032
   22    20 S   C    _C2_    22     1.53413   108.19564  -125.04068
   23    22 S   O    _O2_    23     1.23014   122.28375  -144.23899
   24    20 S   CT   _CB2    32     1.53276   111.50825   112.77382
   25    24 S   HC   HB21    33     1.09660   109.95383    56.01126
   26    24 S   HC   HB22    34     1.09503   110.35972   174.67443
   27    22 S   N    _N3_    24     1.38506   113.38676    43.01722
   28    27 S   H    _HN3    25     1.01515   118.97348    -0.42058
   29    24 S   S    _SG2    35     1.82792   111.92795   -65.42969
   30    27 S   CT   _CA3    26     1.45440   123.32269   175.15507
   31    30 S   HC   HA31    27     1.09532   109.10686    27.02382
   32    30 S   HC   HA32    28     1.09492   107.15920   144.01226
   33    29 S   CA   _C7_    36     1.79065    98.72274   168.89881
   34    30 S   CO3  _C3_    29     1.52931   113.18845   -96.35372
   35    34 S   O2Z  _O31    30     1.26396   115.43585   -43.80517
   36    34 S   O2Z  _O32    31     1.26361   114.95755   137.13090
   37    33 S   CA   _C4_    37     1.40352   118.13206    80.25298
   38    37 S   HA   _H20    38     1.09001   119.62376    -0.22555
   39    37 S   CA   _C6_    39     1.40447   121.21315  -179.78330
   40    39 S   CA   _C8_    40     1.40286   118.86004    -1.01066
   41    40 S   Cl   CL17    41     1.73041   121.72378  -179.48948
   42    39 S   CM   _C11    46     1.46938   118.56872  -179.98022
   43    40 S   CA   _C5_    42     1.39717   120.41689     0.71464
   44    43 S   HA   _H21    43     1.08825   119.86743   179.71061
   45    42 S   CM   _C10    47     1.33798   119.81212    89.71189
   46    45 S   Cl   CL19    48     1.71475   123.87105   179.62361
   47    45 S   HC   _H22    49     1.08278   124.37458    -0.37898
   48    42 S   OS   _O34    50     1.38012   118.39138   -91.11759
   49    33 S   CA   _C9_    44     1.40235   122.89142  -100.31988
   50    49 S   Cl   CL18    45     1.73102   122.27188     0.68156
   51    48 S   P1   _P16    51     1.61522   128.23003     9.07978
   52    51 S   O2Z  _O33    52     1.50152   115.52926   -57.13944
   53    51 S   OS   _O13    53     1.61945   103.87028    69.71401
   54    51 S   OS   _O14    58     1.62058   103.45217   177.95541
   55    53 S   CT   _C12    54     1.41655   118.11334  -178.39258
   56    55 S   HC   _H23    55     1.09238   108.67047  -171.36025
   57    55 S   HC   _H24    56     1.09300   109.67309    69.31876
   58    55 S   HC   _H25    57     1.09312   110.33614   -51.90638
   59    54 S   CT   _C13    59     1.41679   119.77503   -51.18017
   60    59 S   HC   _H26    60     1.09282   108.59709  -175.13848
   61    59 S   HC   _H27    61     1.09287   110.04932    65.81052
   62    59 S   HC   _H28    62     1.09275   110.47826   -55.82566
  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  10   4  11   8   4   9   3   2   4   2   1   6
   1   1  11   4   6   5   3   2   1   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    43    49    50  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    43    44    49    50    42  
   35    36  
   36  
    0  
   38    39    40    41    43    49    50    42    45    48  
   39    40    49    42  
   40    41    43    44    49    42    45    46    47    48    51  
   41    43    44    49    50    42    45    48  
   43    44    49    42  
   45    46    47    48    51    52    53    54    43  
   44    49    50  
   49    50  
   46    47    48    51  
   47    48  
   48  
   51    52    53    55    54    59  
   50  
    0  
   52    53    55    56    57    58    54    59    60    61    62  
   53    55    54    59  
   55    56    57    58    54    59  
   59    60    61    62    55  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62  
   61    62  
   62  
    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  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   38   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   39   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   42   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   44   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   45   3.5500   0.0760   0.005000   2.0020   1.7750   0.023028004  -0.852763146
   46   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   2.8500   0.1400  -0.273200   1.5900   1.4000   0.020110767  -0.896042159
   49   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   50   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   51   3.7400   0.2000   1.230700   2.1070   1.8700   0.005000000   0.000000000
   52   2.9800   0.2000  -0.666100   1.6890   1.4900   0.001000000  -0.126889456
   53   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   54   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   55   3.5000   0.0660   0.092900   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660   0.092900   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   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   367.000  1.080
   37    39   469.000  1.400
   39    40   469.000  1.400
   39    42   320.000  1.460
   40    41   300.000  1.725
   40    43   469.000  1.400
   43    44   367.000  1.080
   43    49   469.000  1.400
   49    50   300.000  1.725
   42    45   549.000  1.340
   42    48   440.000  1.360
   45    46   300.000  1.725
   45    47   340.000  1.080
   48    51   405.000  1.623
   51    52   675.000  1.490
   51    53   405.000  1.623
   51    54   405.000  1.623
   53    55   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   54    59   320.000  1.410
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   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  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    35.00000  120.00000
   33    37    39    63.00000  120.00000
   33    49    43    63.00000  120.00000
   33    49    50    75.00000  120.00000
   37    39    40    63.00000  120.00000
   37    39    42    60.00000  120.93500
   39    37    38    35.00000  120.00000
   39    40    41    75.00000  120.00000
   39    40    43    63.00000  120.00000
   39    42    45    60.00000  123.20500
   39    42    48    85.00000  114.86500
   40    43    44    35.00000  120.00000
   40    43    49    63.00000  120.00000
   43    40    41    75.00000  120.00000
   43    49    50    75.00000  120.00000
   49    33    37    63.00000  120.00000
   49    43    44    35.00000  120.00000
   42    39    40    60.00000  120.93500
   42    45    46    75.00000  121.50000
   42    45    47    35.00000  120.00000
   42    48    51    80.00000  120.00000
   47    45    46    60.00000  114.00000
   48    42    45    80.00000  120.01400
   48    51    52   100.00000  115.86100
   48    51    53   120.00000  102.38000
   48    51    54   120.00000  102.38000
   51    53    55    75.00000  119.24600
   51    54    59    75.00000  119.24600
   53    51    52   100.00000  115.86100
   53    55    56    35.00000  109.50000
   53    55    57    35.00000  109.50000
   53    55    58    35.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   54    51    52   100.00000  115.86100
   54    51    53   120.00000  102.38000
   54    59    60    35.00000  109.50000
   54    59    61    35.00000  109.50000
   54    59    62    35.00000  109.50000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    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  -0.35400  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    43   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    43   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    43   3.62500 -1.0 2.0
   37    39    42    45   0.15800  1.0 1.0
   37    39    42    45   1.85350 -1.0 2.0
   37    39    42    45  -0.48700  1.0 3.0
   37    39    42    48  -0.01750  1.0 1.0
   37    39    42    48  -0.32000 -1.0 2.0
   37    39    42    48   0.00600  1.0 3.0
   38    37    39    40   3.62500 -1.0 2.0
   38    37    39    42   3.62500 -1.0 2.0
   39    40    43    44   3.62500 -1.0 2.0
   39    40    43    49   3.62500 -1.0 2.0
   39    42    45    46   7.00000 -1.0 2.0
   39    42    45    47   7.00000 -1.0 2.0
   39    42    48    51   2.00000 -1.0 2.0
   40    39    42    45   0.15800  1.0 1.0
   40    39    42    45   1.85350 -1.0 2.0
   40    39    42    45  -0.48700  1.0 3.0
   40    39    42    48  -0.01750  1.0 1.0
   40    39    42    48  -0.32000 -1.0 2.0
   40    39    42    48   0.00600  1.0 3.0
   40    43   -49    33   3.62500 -1.0 2.0
   40    43    49    50   3.62500 -1.0 2.0
   41    40    43    44   3.62500 -1.0 2.0
   41    40    43    49   3.62500 -1.0 2.0
   44    43    49    33   3.62500 -1.0 2.0
   44    43    49    50   3.62500 -1.0 2.0
   49    33    37    38   3.62500 -1.0 2.0
   49    33   -37    39   3.62500 -1.0 2.0
   42    39    40    41   3.62500 -1.0 2.0
   42    39    40    43   3.62500 -1.0 2.0
   42    48    51    52   0.00000  1.0 1.0
   42    48    51    53   0.88300  1.0 1.0
   42    48    51    53   0.16450 -1.0 2.0
   42    48    51    53   0.32850  1.0 3.0
   42    48    51    54   0.88300  1.0 1.0
   42    48    51    54   0.16450 -1.0 2.0
   42    48    51    54   0.32850  1.0 3.0
   45    42    48    51   2.00000 -1.0 2.0
   48    42    45    46   7.00000 -1.0 2.0
   48    42    45    47   7.00000 -1.0 2.0
   48    51    53    55   0.91800  1.0 1.0
   48    51    53    55   0.22900 -1.0 2.0
   48    51    53    55   0.32050  1.0 3.0
   48    51    54    59   0.91800  1.0 1.0
   48    51    54    59   0.22900 -1.0 2.0
   48    51    54    59   0.32050  1.0 3.0
   51    53    55    56   0.03000  1.0 3.0
   51    53    55    57   0.03000  1.0 3.0
   51    53    55    58   0.03000  1.0 3.0
   51    54    59    60   0.03000  1.0 3.0
   51    54    59    61   0.03000  1.0 3.0
   51    54    59    62   0.03000  1.0 3.0
   52    51    53    55   0.00000  1.0 1.0
   52    51    54    59   0.00000  1.0 1.0
   53    51    54    59   0.91800  1.0 1.0
   53    51    54    59   0.22900 -1.0 2.0
   53    51    54    59   0.32050  1.0 3.0
   54    51    53    55   0.91800  1.0 1.0
   54    51    53    55   0.22900 -1.0 2.0
   54    51    53    55   0.32050  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    49    33    29   4.00000 -1.0 2.0
   39    38    37    33   1.10000 -1.0 2.0
   40    42    39    37   4.00000 -1.0 2.0
   43    41    40    39   4.00000 -1.0 2.0
   49    44    43    40   1.10000 -1.0 2.0
   43    50    49    33   4.00000 -1.0 2.0
   39    48    42    45  15.00000 -1.0 2.0
   46    47    45    42  15.00000 -1.0 2.0
END
