* LIGAND DATABASE FILE (OPLS2005)
*
001      60    60    109    167     323
    1     0 S   NP   _N1_     1    29.13019    93.83264   -19.14150
    2     1 S   H    _HN1     2     1.02959   104.14820    32.74652
    3     1 S   H    _H1_     3     1.02841    33.94009   132.33346
    4     1 S   H    _H2_     4     1.02782    77.15178   -73.21704
    5     1 S   CT   _CA1     5     1.50116   138.01106   177.68971
    6     5 S   HC   _HA1     6     1.09558   105.30717    34.17316
    7     5 S   CO3  _C1_     7     1.53913   112.26446   -86.29752
    8     7 S   O2Z  _O11     8     1.26381   115.03109   -43.80683
    9     7 S   O2Z  _O12     9     1.26223   114.95421   135.43516
   10     5 S   CT   _CB1    10     1.53092   107.45270   152.34509
   11    10 S   HC   HB11    11     1.09817   109.72241   -47.67220
   12    10 S   HC   HB12    12     1.09843   110.20817    68.92809
   13    10 S   CT   _CG1    13     1.53075   112.65856  -168.72275
   14    13 S   HC   HG11    14     1.09525   110.41226   -54.72896
   15    13 S   HC   HG12    15     1.09599   110.27194    64.33128
   16    13 S   C    _CD1    16     1.51823   111.70092  -175.59749
   17    16 S   O    _OE1    17     1.22754   122.96006   -20.40217
   18    16 S   N    _N2_    18     1.38557   111.94854   160.18311
   19    18 S   H    _HN2    19     1.01584   119.10261     2.35900
   20    18 S   CT1  _CA2    20     1.46274   123.38786  -176.29081
   21    20 S   HC   _HA2    21     1.09728   109.41022   -15.61427
   22    20 S   C    _C2_    22     1.53370   108.25656  -131.43739
   23    22 S   O    _O2_    23     1.23003   122.29228  -145.09559
   24    20 S   CT   _CB2    32     1.53592   111.14038   106.49299
   25    24 S   HC   HB21    33     1.09302   109.29467    56.03496
   26    24 S   HC   HB22    34     1.09522   110.50291   173.92998
   27    22 S   N    _N3_    24     1.38524   113.29709    42.22675
   28    27 S   H    _HN3    25     1.01533   118.91467    -0.46855
   29    24 S   S    _SG2    35     1.83117   111.46170   -67.35993
   30    27 S   CT   _CA3    26     1.45449   123.39666   175.11533
   31    30 S   HC   HA31    27     1.09527   109.16785    25.53486
   32    30 S   HC   HA32    28     1.09493   107.13221   142.53415
   33    29 S   CT   _C5_    36     1.87538   102.55548   142.78794
   34    30 S   CO3  _C3_    29     1.52936   113.19178   -97.89215
   35    34 S   O2Z  _O31    30     1.26396   115.44381   -43.32588
   36    34 S   O2Z  _O32    31     1.26361   114.95475   137.62133
   37    33 S   CT   _C6_    37     1.55281   106.83087   172.60623
   38    37 S   HC   _H8_    38     1.09904   110.01993   -56.93758
   39    37 S   HC   _H9_    39     1.09822   109.64803  -172.03307
   40    33 S   CT   _C4_    57     1.54075   107.49507    56.18558
   41    40 S   HC   _H5_    58     1.09472   112.18889   -72.12449
   42    40 S   HC   _H6_    59     1.09583   111.48334   167.99863
   43    40 S   HC   _H7_    60     1.09671   111.67439    49.43536
   44    37 S   CM   _C7_    40     1.51366   113.28784    67.60186
   45    44 S   CT   _C9_    41     1.51555   116.83984    51.44180
   46    45 S   HC   _H3_    42     1.10039   107.98423  -160.32948
   47    44 S   CM   _C8_    54     1.34318   121.42130  -126.74716
   48    47 S   HC   _H10    55     1.08506   121.37956   179.16514
   49    47 S   HC   _H11    56     1.08498   121.42391    -0.91792
   50    45 S   CT   _C10    43     1.54345   111.39826   -44.89262
   51    50 S   HC   _H12    44     1.09843   110.17891   169.13130
   52    50 S   HC   _H13    45     1.09707   107.21355   -77.29186
   53    45 S   CM   _C12    49     1.51099   111.22872    82.30327
   54    53 S   HC   _H14    50     1.08687   118.05411   -50.47545
   55    33 S   CT   _C11    46     1.55813   110.46642   -68.01517
   56    55 S   Cl   Cl1_    47     1.80254   112.18264   168.84776
   57    55 S   HC   _H4_    48     1.09346   110.47798    54.27794
   58    53 S   CM   _C13    51     1.33687   123.04351   128.88900
   59    58 S   Cl   Cl2_    52     1.71276   122.95324  -179.72024
   60    58 S   HC   _H15    53     1.08218   124.47058     0.62683
  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
  16   2   1   1  17   6   5   8   3   2   1  12  15   8   4   1
   1   8   5   4   5   3   2   1   1   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    55    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    44    50    55    56    57    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    45    50    51    52    55    56    57    47    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    45    46    50    55    56    57    53    47    48    49    40    41    42    43  
   39    44    45    55    47    40  
   44    45    55    47    40  
   41    42    43    44    50    55    56    57  
   42    43    55  
   43    55  
   55  
   45    46    50    51    52    55    53    54    58    47    48    49  
   46    50    51    52    55    56    57    53    54    58    59    60    47    48    49  
   50    51    52    55    53    54    58    47  
   48    49    50    53  
   49  
    0  
   51    52    55    56    57    53    54    58  
   52    55    56    57    53  
   55    56    57    53  
   54    58    59    60    55  
   58    59    60  
   56    57  
   57  
    0  
   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   0.167500   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   56   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   57   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760   0.005000   2.0020   1.7750   0.023028004  -0.852763146
   59   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   60   2.4200   0.0300   0.115000   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   222.000  1.810
   33    37   268.000  1.529
   33    55   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    44   317.000  1.510
   44    45   317.000  1.510
   44    47   549.000  1.340
   45    46   340.000  1.090
   45    50   268.000  1.529
   45    53   317.000  1.510
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    55   268.000  1.529
   55    56   245.000  1.781
   55    57   340.000  1.090
   53    54   340.000  1.080
   53    58   549.000  1.340
   58    59   300.000  1.725
   58    60   340.000  1.080
   47    48   340.000  1.080
   47    49   340.000  1.080
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   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    55    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    44    70.00000  112.02700
   33    55    50    58.35000  112.70000
   33    55    56    69.00000  109.80000
   33    55    57    37.50000  110.70000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    65.00000  117.92700
   37    44    47    70.00000  124.00000
   39    37    38    33.00000  107.80000
   44    37    38    35.00000  109.50000
   44    37    39    35.00000  109.50000
   44    45    46    35.00000  109.50000
   44    45    50    70.00000  112.02700
   44    45    53    70.00000  110.12100
   44    47    48    35.00000  120.00000
   44    47    49    35.00000  120.00000
   45    50    51    37.50000  110.70000
   45    50    52    37.50000  110.70000
   45    50    55    58.35000  112.70000
   45    53    54    35.00000  117.00000
   45    53    58    70.00000  124.00000
   50    45    46    37.50000  110.70000
   50    55    56    69.00000  109.80000
   50    55    57    37.50000  110.70000
   52    50    51    33.00000  107.80000
   55    33    37    58.35000  112.70000
   55    50    51    37.50000  110.70000
   55    50    52    37.50000  110.70000
   57    55    56    51.00000  107.60000
   53    45    46    35.00000  109.50000
   53    45    50    70.00000  112.02700
   53    58    59    75.00000  121.50000
   53    58    60    35.00000  120.00000
   58    53    54    35.00000  120.00000
   60    58    59    60.00000  114.00000
   47    44    45    70.00000  124.00000
   49    47    48    35.00000  117.00000
   40    33    37    58.35000  112.70000
   40    33    55    58.35000  112.70000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    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    55   0.01700  1.0 1.0
   24    29    33    55  -0.23550 -1.0 2.0
   24    29    33    55   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    44   0.56750  1.0 1.0
   29    33    37    44  -0.07550 -1.0 2.0
   29    33    37    44   0.20000  1.0 3.0
   29    33    55    50   0.44750  1.0 1.0
   29    33    55    50  -0.17800 -1.0 2.0
   29    33    55    50   0.20200  1.0 3.0
   29    33    55    56   0.56750  1.0 1.0
   29    33    55    56  -0.07550 -1.0 2.0
   29    33    55    56   0.20000  1.0 3.0
   29    33    55    57   0.15000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    43   0.15000  1.0 3.0
   33    37    44    45   0.46850  1.0 1.0
   33    37    44    45   0.08550 -1.0 2.0
   33    37    44    45   0.09800  1.0 3.0
   33    37    44    47   0.09850  1.0 1.0
   33    37    44    47   0.15250 -1.0 2.0
   33    37    44    47  -0.50650  1.0 3.0
   37    33    55    50   0.56750  1.0 1.0
   37    33    55    50  -0.07550 -1.0 2.0
   37    33    55    50   0.20000  1.0 3.0
   37    33    55    56   0.35600  1.0 1.0
   37    33    55    56  -0.14650 -1.0 2.0
   37    33    55    56   0.33350  1.0 3.0
   37    33    55    57   0.15000  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    43   0.15000  1.0 3.0
   37    44    45    46   0.34800  1.0 3.0
   37    44   -45    50   0.46850  1.0 1.0
   37    44   -45    50   0.08550 -1.0 2.0
   37    44   -45    50   0.09800  1.0 3.0
   37    44    45    53   0.09700  1.0 1.0
   37    44    45    53   0.15600 -1.0 2.0
   37    44    45    53  -0.50800  1.0 3.0
   37    44    47    48   7.00000 -1.0 2.0
   37    44    47    49   7.00000 -1.0 2.0
   38    37    44    45   0.34800  1.0 3.0
   38    37    44    47   0.00000  1.0 1.0
   39    37    44    45   0.34800  1.0 3.0
   39    37    44    47   0.00000  1.0 1.0
   44    45    50    51   0.15000  1.0 3.0
   44    45    50    52   0.15000  1.0 3.0
   44    45    50    55   0.34400  1.0 1.0
   44    45    50    55   0.09450 -1.0 2.0
   44    45    50    55   0.11100  1.0 3.0
   44    45    53    54   0.00000  1.0 1.0
   44    45    53    58  -0.28300  1.0 1.0
   44    45    53    58   0.26700 -1.0 2.0
   44    45    53    58  -0.63300  1.0 3.0
   45    44    47    48   7.00000 -1.0 2.0
   45    44    47    49   7.00000 -1.0 2.0
   45    50   -55    33   0.56750  1.0 1.0
   45    50   -55    33  -0.07550 -1.0 2.0
   45    50   -55    33   0.20000  1.0 3.0
   45    50    55    56   0.35600  1.0 1.0
   45    50    55    56  -0.14650 -1.0 2.0
   45    50    55    56   0.33350  1.0 3.0
   45    50    55    57   0.15000  1.0 3.0
   45    53    58    59   7.00000 -1.0 2.0
   45    53    58    60   7.00000 -1.0 2.0
   46    45    50    51   0.15000  1.0 3.0
   46    45    50    52   0.15000  1.0 3.0
   46    45    50    55   0.15000  1.0 3.0
   46    45    53    54   0.33100  1.0 3.0
   46    45    53    58   0.00000  1.0 1.0
   50    45    53    54   0.00000  1.0 1.0
   50    45    53    58   0.09850  1.0 1.0
   50    45    53    58   0.15250 -1.0 2.0
   50    45    53    58  -0.50650  1.0 3.0
   51    50    55    33   0.15000  1.0 3.0
   51    50    55    56   0.27000  1.0 3.0
   51    50    55    57   0.15000  1.0 3.0
   52    50    55    33   0.15000  1.0 3.0
   52    50    55    56   0.27000  1.0 3.0
   52    50    55    57   0.15000  1.0 3.0
   55    33    37    38   0.15000  1.0 3.0
   55    33    37    39   0.15000  1.0 3.0
   55    33   -37    44   0.34400  1.0 1.0
   55    33   -37    44   0.09450 -1.0 2.0
   55    33   -37    44   0.11100  1.0 3.0
   55    33    40    41   0.15000  1.0 3.0
   55    33    40    42   0.15000  1.0 3.0
   55    33    40    43   0.15000  1.0 3.0
   53    45    50    51   0.15000  1.0 3.0
   53    45    50    52   0.15000  1.0 3.0
   53    45    50    55   0.34400  1.0 1.0
   53    45    50    55   0.09450 -1.0 2.0
   53    45    50    55   0.11100  1.0 3.0
   54    53    58    59   7.00000 -1.0 2.0
   54    53    58    60   7.00000 -1.0 2.0
   47    44    45    46   0.00000  1.0 1.0
   47    44    45    50   0.09850  1.0 1.0
   47    44    45    50   0.15250 -1.0 2.0
   47    44    45    50  -0.50650  1.0 3.0
   47    44    45    53  -0.28300  1.0 1.0
   47    44    45    53   0.26700 -1.0 2.0
   47    44    45    53  -0.63300  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    44   0.34400  1.0 1.0
   40    33    37    44   0.09450 -1.0 2.0
   40    33    37    44   0.11100  1.0 3.0
   40    33    55    50   0.56750  1.0 1.0
   40    33    55    50  -0.07550 -1.0 2.0
   40    33    55    50   0.20000  1.0 3.0
   40    33    55    56   0.35600  1.0 1.0
   40    33    55    56  -0.14650 -1.0 2.0
   40    33    55    56   0.33350  1.0 3.0
   40    33    55    57   0.15000  1.0 3.0
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    45    44    47   1.10000 -1.0 2.0
   45    54    53    58  15.00000 -1.0 2.0
   59    60    58    53  15.00000 -1.0 2.0
   48    49    47    44   1.10000 -1.0 2.0
END
