* LIGAND DATABASE FILE (OPLS2005)
*
001      62    63    106    170     312
    1     0 S   NP   _N1_     1    28.90662    96.38010   -22.32298
    2     1 S   H    _HN1     2     1.02947    74.30867    -8.31621
    3     1 S   H    _H1_     3     1.02823    36.24873   145.83839
    4     1 S   H    _H2_     4     1.02790   104.60492  -113.69379
    5     1 S   CT   _CA1     5     1.50122   138.29522    94.92196
    6     5 S   HC   _HA1     6     1.09572   105.19633    88.74682
    7     5 S   CO3  _C1_     7     1.53804   112.35170   -31.53579
    8     7 S   O2Z  _O11     8     1.26378   115.00198   -43.48503
    9     7 S   O2Z  _O12     9     1.26220   114.96758   135.44063
   10     5 S   CT   _CB1    10     1.53058   107.39309  -153.18488
   11    10 S   HC   HB11    11     1.09838   109.53043   -48.05412
   12    10 S   HC   HB12    12     1.09806   110.43530    68.61884
   13    10 S   CT   _CG1    13     1.52966   112.52141  -168.88619
   14    13 S   HC   HG11    14     1.09552   110.71270   -65.19821
   15    13 S   HC   HG12    15     1.09645   109.62756    54.12760
   16    13 S   C    _CD1    16     1.51760   112.01279   174.73058
   17    16 S   O    _OE1    17     1.22754   123.17716    13.56716
   18    16 S   N    _N2_    18     1.38622   111.86345  -166.92257
   19    18 S   H    _HN2    19     1.01582   118.92869     2.28293
   20    18 S   CT1  _CA2    20     1.46226   123.32294   178.11789
   21    20 S   HC   _HA2    21     1.09706   109.35240     5.90804
   22    20 S   C    _C2_    22     1.53593   108.98472  -110.02920
   23    22 S   O    _O2_    23     1.23089   122.05080  -151.24042
   24    20 S   CT   _CB2    32     1.53265   111.45380   127.90723
   25    24 S   HC   HB21    33     1.09491   109.54635    60.90855
   26    24 S   HC   HB22    34     1.09562   110.68884   178.69104
   27    22 S   N    _N3_    24     1.38239   113.98748    35.91581
   28    27 S   H    _HN3    25     1.01563   119.58281    -3.11634
   29    24 S   S    _SG2    35     1.82979   111.72632   -61.47834
   30    27 S   CT   _CA3    26     1.45274   123.30040   177.58071
   31    30 S   HC   HA31    27     1.09544   107.50741   -65.41537
   32    30 S   HC   HA32    28     1.09557   108.00614    51.05469
   33    29 S   CA   _C16    36     1.78915    99.24118   156.04117
   34    30 S   CO3  _C3_    29     1.52974   114.02875   173.06913
   35    34 S   O2Z  _O31    30     1.26382   116.06979     0.35936
   36    34 S   O2Z  _O32    31     1.26423   114.41854  -179.58741
   37    33 S   CA   _C15    37     1.40204   118.15331   100.56335
   38    37 S   HA   _H11    38     1.08835   120.64288     0.15451
   39    37 S   CA   _C14    39     1.39774   120.78346  -179.52358
   40    39 S   HA   _H10    40     1.08696   118.73511   179.48528
   41    39 S   CA   _C13    41     1.39749   119.41626    -0.16071
   42    41 S   CA   _C12    42     1.39666   121.09755    -0.15577
   43    42 S   HA   _H9_    43     1.08737   121.39756  -178.97531
   44    41 S   NO2  _N5_    60     1.45822   119.44416   179.96044
   45    44 S   ON   _O35    61     1.23844   117.66858    22.49074
   46    44 S   ON   _O34    62     1.23853   117.61222  -157.43616
   47    33 S   CA   _C11    44     1.40674   123.12713   -79.43819
   48    47 S   C    _C10    45     1.47778   121.46985    -1.26563
   49    48 S   O    _O33    46     1.22350   117.97669   -73.27460
   50    48 S   N    _N4_    47     1.38431   112.83155   106.06222
   51    50 S   H    _H8_    48     1.01725   117.43545    -0.32686
   52    50 S   CA   _C7_    49     1.41350   127.17289  -178.12476
   53    52 S   CA   _C6_    50     1.39758   124.16785    -3.55242
   54    53 S   HA   _H5_    51     1.08436   122.32858    -0.86660
   55    53 S   CA   _C5_    52     1.39846   120.26080   179.21093
   56    55 S   HA   _H4_    53     1.08672   119.72489  -179.98022
   57    55 S   CA   _C4_    54     1.39261   120.41190    -0.04846
   58    57 S   HA   _H3_    55     1.08599   120.09087  -179.83449
   59    57 S   CA   _C9_    56     1.39150   119.74412     0.23155
   60    59 S   HA   _H7_    57     1.08625   120.03321   179.98022
   61    52 S   CA   _C8_    58     1.40247   116.93710   175.93885
   62    61 S   HA   _H6_    59     1.08771   120.69544     0.42658
  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
  11   2   1   1   8   4   8   3   7   8   3   3   1   1   5   6
   3   8   3   9   8   4   6   3   5   3   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    47    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    42    47    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    42    43    47    48    49    50  
   35    36  
   36  
    0  
   38    39    40    41    42    47    48    44  
   39    40    41    47  
   40    41    42    43    47    44    45    46  
   41    42    44  
   42    43    47    48    44    45    46  
   43    47    48    49    50    44    45    46  
   47    48    44  
   45    46    47  
   46  
    0  
   48    49    50    51    52  
   49    50    51    52    53    61  
   50    51    52  
   51    52    53    54    55    59    61    62  
   52    53    61  
   53    54    55    56    57    59    60    61    62  
   54    55    56    57    58    59    61    62  
   55    56    57    61  
   56    57    58    59    60    61  
   57    58    59  
   58    59    60    61    62  
   59    60    61  
   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  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   40   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   41   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   45   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   46   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   47   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.7500   0.1050   0.615000   1.9250   1.7000   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   50   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   51   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   52   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    47   469.000  1.400
   37    38   367.000  1.080
   37    39   469.000  1.400
   39    40   367.000  1.080
   39    41   469.000  1.400
   41    42   469.000  1.400
   41    44   400.000  1.460
   42    43   367.000  1.080
   42    47   469.000  1.400
   47    48   400.000  1.490
   48    49   570.000  1.229
   48    50   490.000  1.335
   50    51   434.000  1.010
   50    52   360.000  1.404
   52    53   469.000  1.400
   52    61   469.000  1.400
   53    54   367.000  1.080
   53    55   469.000  1.400
   55    56   367.000  1.080
   55    57   469.000  1.400
   57    58   367.000  1.080
   57    59   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   367.000  1.080
   44    45   550.000  1.225
   44    46   550.000  1.225
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    47    85.00000  119.40000
   33    37    38    35.00000  120.00000
   33    37    39    63.00000  120.00000
   33    47    42    63.00000  120.00000
   33    47    48    85.00000  120.00000
   37    39    40    35.00000  120.00000
   37    39    41    63.00000  120.00000
   39    37    38    35.00000  120.00000
   39    41    42    63.00000  120.00000
   39    41    44    85.00000  120.00000
   41    39    40    35.00000  120.00000
   41    42    43    35.00000  120.00000
   41    42    47    63.00000  120.00000
   41    44    45    80.00000  117.50000
   41    44    46    80.00000  117.50000
   42    47    48    85.00000  120.00000
   47    33    37    63.00000  120.00000
   47    42    43    35.00000  120.00000
   47    48    49    80.00000  120.40000
   47    48    50    75.00000  113.92100
   48    50    51    35.00000  119.80000
   48    50    52    65.00000  121.96500
   50    48    49    80.00000  122.90000
   50    52    53    70.00000  119.01900
   50    52    61    70.00000  119.01900
   52    50    51    45.00000  118.23600
   52    53    54    35.00000  120.00000
   52    53    55    63.00000  120.00000
   52    61    59    63.00000  120.00000
   52    61    62    35.00000  120.00000
   53    55    56    35.00000  120.00000
   53    55    57    63.00000  120.00000
   55    53    54    35.00000  120.00000
   55    57    58    35.00000  120.00000
   55    57    59    63.00000  120.00000
   57    55    56    35.00000  120.00000
   57    59    60    35.00000  120.00000
   57    59    61    63.00000  120.00000
   59    57    58    35.00000  120.00000
   59    61    62    35.00000  120.00000
   61    52    53    63.00000  120.00000
   61    59    60    35.00000  120.00000
   44    41    42    85.00000  120.00000
   46    44    45    80.00000  125.30000
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    47   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    47    42   3.62500 -1.0 2.0
   29    33    47    48   3.62500 -1.0 2.0
   33    37    39    40   3.62500 -1.0 2.0
   33    37    39    41   3.62500 -1.0 2.0
   33    47    48    49   1.05000 -1.0 2.0
   33    47    48    50   0.75700  1.0 1.0
   33    47    48    50   0.34650 -1.0 2.0
   33    47    48    50   0.33000  1.0 3.0
   33    47    48    50  -0.28100 -1.0 4.0
   37    33    47    42   3.62500 -1.0 2.0
   37    33    47    48   3.62500 -1.0 2.0
   37    39   -41    42   3.62500 -1.0 2.0
   37    39    41    44   3.62500 -1.0 2.0
   38    37    39    40   3.62500 -1.0 2.0
   38    37    39    41   3.62500 -1.0 2.0
   39    41    42    43   3.62500 -1.0 2.0
   39    41    42    47   3.62500 -1.0 2.0
   39    41    44    45   0.69950 -1.0 2.0
   39    41    44    46   0.69950 -1.0 2.0
   40    39    41    42   3.62500 -1.0 2.0
   40    39    41    44   3.62500 -1.0 2.0
   41    42   -47    33   3.62500 -1.0 2.0
   41    42    47    48   3.62500 -1.0 2.0
   42    41    44    45   0.69950 -1.0 2.0
   42    41    44    46   0.69950 -1.0 2.0
   42    47    48    49   1.05000 -1.0 2.0
   42    47    48    50   0.75700  1.0 1.0
   42    47    48    50   0.34650 -1.0 2.0
   42    47    48    50   0.33000  1.0 3.0
   42    47    48    50  -0.28100 -1.0 4.0
   43    42    47    33   3.62500 -1.0 2.0
   43    42    47    48   3.62500 -1.0 2.0
   47    33    37    38   3.62500 -1.0 2.0
   47    33   -37    39   3.62500 -1.0 2.0
   47    48    50    51   2.56700 -1.0 2.0
   47    48    50    52   0.76000  1.0 1.0
   47    48    50    52   4.11600 -1.0 2.0
   48    50    52    53   1.00100  1.0 1.0
   48    50    52    53   0.85050 -1.0 2.0
   48    50    52    61   1.00100  1.0 1.0
   48    50    52    61   0.85050 -1.0 2.0
   49    48    50    51   2.45000 -1.0 2.0
   49    48    50    52   0.04000 -1.0 2.0
   50    52    53    54   3.62500 -1.0 2.0
   50    52    53    55   3.62500 -1.0 2.0
   50    52    61    59   3.62500 -1.0 2.0
   50    52    61    62   3.62500 -1.0 2.0
   51    50    52    53   0.97800 -1.0 2.0
   51    50    52    61   0.97800 -1.0 2.0
   52    53    55    56   3.62500 -1.0 2.0
   52    53    55    57   3.62500 -1.0 2.0
   53    52    61    59   3.62500 -1.0 2.0
   53    52    61    62   3.62500 -1.0 2.0
   53    55    57    58   3.62500 -1.0 2.0
   53    55   -57    59   3.62500 -1.0 2.0
   54    53    55    56   3.62500 -1.0 2.0
   54    53    55    57   3.62500 -1.0 2.0
   55    57    59    60   3.62500 -1.0 2.0
   55    57    59    61   3.62500 -1.0 2.0
   56    55    57    58   3.62500 -1.0 2.0
   56    55    57    59   3.62500 -1.0 2.0
   57    59   -61    52   3.62500 -1.0 2.0
   57    59    61    62   3.62500 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   58    57    59    61   3.62500 -1.0 2.0
   60    59    61    52   3.62500 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   61    52    53    54   3.62500 -1.0 2.0
   61    52   -53    55   3.62500 -1.0 2.0
   44    41    42    43   3.62500 -1.0 2.0
   44    41    42    47   3.62500 -1.0 2.0
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    47    33    29   4.00000 -1.0 2.0
   39    38    37    33   1.10000 -1.0 2.0
   41    40    39    37   1.10000 -1.0 2.0
   42    44    41    39   4.00000 -1.0 2.0
   47    43    42    41   1.10000 -1.0 2.0
   42    48    47    33   4.00000 -1.0 2.0
   47    50    48    49  10.50000 -1.0 2.0
   51    48    50    52   1.00000 -1.0 2.0
   53    61    52    50   4.00000 -1.0 2.0
   55    54    53    52   1.10000 -1.0 2.0
   57    56    55    53   1.10000 -1.0 2.0
   59    58    57    55   1.10000 -1.0 2.0
   61    60    59    57   1.10000 -1.0 2.0
   59    62    61    52   1.10000 -1.0 2.0
   45    41    44    46  10.50000 -1.0 2.0
END
