* LIGAND DATABASE FILE (OPLS2005)
*
001      61    62    110    167     319
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02029    89.59685    41.07328
    3     1 S   H    _H1_     3     1.02154    32.90493   168.04287
    4     1 S   H    _H2_     4     1.02096    90.91299   -67.61916
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    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     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04690   118.93088     8.54895
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08448   106.42696   -11.15906
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08733   110.25787    59.09629
   26    24 S   HC   HB22    34     1.08755   109.66015   178.71915
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C11    36     1.82290    99.26046   -79.98454
   34    33 S   Cl   Cl2_    37     1.78905   108.62970   -79.23992
   35    33 S   HC   _H4_    38     1.09353   109.58376    36.71062
   36    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   37    36 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   38    36 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   39    33 S   CT   _C10    39     1.53147   112.06110   159.96883
   40    39 S   HC   _H3_    40     1.09809   106.70155   176.67946
   41    39 S   NM   _N5_    41     1.46664   108.73854   -62.66745
   42    39 S   NE   _N6_    54     1.46121   108.22541    60.24902
   43    42 S   H    _H9_    55     1.01426   118.59613    32.16165
   44    41 S   SY   _S2_    42     1.59654   111.58157  -176.64590
   45    44 S   OY   _O35    43     1.45985   113.76590  -157.83027
   46    44 S   OY   _O36    44     1.46048   115.32134    65.19892
   47    44 S   CA   _C6_    45     1.79354   105.66835   -46.08000
   48    47 S   CA   _C7_    46     1.39542   119.33425  -162.23756
   49    48 S   HA   _H6_    47     1.08666   120.69732    -2.21143
   50    48 S   CA   _C8_    48     1.39069   118.85915   177.79149
   51    50 S   CA   _C9_    49     1.39517   119.95736    -0.45197
   52    51 S   Cl   Cl1_    50     1.72711   121.70179  -179.53186
   53    50 S   SY   _S1_    56     1.75202   118.03726   179.78971
   54    53 S   OY   _O33    57     1.45438   108.16648  -155.76883
   55    53 S   OY   _O34    58     1.45411   108.29255   -24.17609
   56    51 S   CA   _C4_    51     1.39949   120.29692     0.34887
   57    56 S   HA   _H5_    52     1.08882   119.75419  -179.73312
   58    53 S   NS   _N4_    59     1.70745   100.75909    89.97715
   59    58 S   H    _H7_    60     1.02808   117.90595   108.51448
   60    58 S   H    _H8_    61     1.02709   117.93746  -108.53180
   61    47 S   CA   _C5_    53     1.40088   117.90860    15.98514
  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   7   5   4   3
   9   5   4   2   1   1  10   5   8   8   3   8   4   3   8  10
   4  11   8   4   6   4   3   2   1   2   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    44    61    42    43  
   35    39    40    41    42  
   39    40    41    42  
   37    38  
   38  
    0  
   40    41    44    45    46    47    56    61    42    43  
   41    44    61    42    43  
   44    45    46    47    48    61    42    43  
   43    44    47    48    51    56    57    61  
   47    56    61  
   45    46    47    48    49    50    56    61  
   46    47    48    61  
   47    48    61  
   48    49    50    51    56    57    61    53  
   49    50    51    52    56    61    53    54    55    58  
   50    51    61    53  
   51    52    56    57    61    53    54    55    58    59    60  
   52    56    57    61    53    54    55    58  
   56    57    61    53  
   54    55    58    59    60    56  
   55    58    59    60  
   58    59    60  
   57    61  
   61  
   59    60  
   60  
    0  
    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  -0.175000   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   0.104500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   35   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   4.2000   0.3000   0.558100   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0150  -0.153700   1.4250   1.2500   0.008598240   0.268726247
   41   3.4200   0.1700  -1.076600   1.9310   1.7100   0.005000000   0.000000000
   42   3.3000   0.1700  -0.702500   1.8650   1.6500   0.051222218  -2.220205820
   43   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   44   3.5500   0.2500   1.758100   2.0020   1.7750   0.025682759  -1.666211680
   45   2.9600   0.1700  -0.784100   1.6780   1.4800   0.001000000  -0.126889456
   46   2.9600   0.1700  -0.784100   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5500   0.0700  -0.395200   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0700   0.156700   2.5000   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   52   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   53   3.5500   0.2500   0.832700   2.0020   1.7750   0.025682759  -1.666211680
   54   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   55   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.2500   0.1700  -0.767800   1.8100   1.6000   0.054801302  -1.445846770
   59   0.5000   0.0300   0.357200   0.9960   0.8600   0.030040813  -0.651083722
   60   0.5000   0.0300   0.357200   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0700   0.200000   2.5000   1.7750   0.001000000  -0.843144165
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    34   245.000  1.781
   33    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   320.000  1.444
   39    42   382.000  1.448
   41    44   350.000  1.613
   44    45   735.000  1.471
   44    46   735.000  1.471
   44    47   225.000  1.779
   47    48   469.000  1.400
   47    61   469.000  1.400
   48    49   367.000  1.080
   48    50   469.000  1.400
   50    51   469.000  1.400
   50    53   225.000  1.779
   51    52   300.000  1.725
   51    56   469.000  1.400
   56    57   367.000  1.080
   56    61   469.000  1.400
   61    42   481.000  1.340
   42    43   434.000  1.010
   53    54   735.000  1.471
   53    55   735.000  1.471
   53    58   245.000  1.722
   58    59   500.000  1.020
   58    60   500.000  1.020
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    34    85.00000  110.65400
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    80.00000  110.21000
   33    39    42    80.00000  111.61500
   35    33    34    51.00000  107.60000
   39    33    34    69.00000  109.80000
   39    33    35    37.50000  110.70000
   39    41    44    80.00000  116.74600
   39    42    61    50.00000  120.00000
   39    42    43    35.00000  112.50000
   41    39    40    45.00000  113.03500
   41    44    45   105.00000  114.79700
   41    44    46   105.00000  114.79700
   41    44    47   105.00000   98.50000
   44    47    48    65.00000  117.06700
   44    47    61    65.00000  117.06700
   46    44    45   115.00000  120.17200
   47    44    45   100.00000  107.67100
   47    44    46   100.00000  107.67100
   47    48    49    35.00000  120.00000
   47    48    50    63.00000  120.00000
   47    61    56    63.00000  120.00000
   47    61    42    70.00000  120.10000
   48    50    51    63.00000  120.00000
   48    50    53    65.00000  117.06700
   50    48    49    35.00000  120.00000
   50    51    52    75.00000  120.00000
   50    51    56    63.00000  120.00000
   50    53    54   100.00000  107.67100
   50    53    55   100.00000  107.67100
   50    53    58    95.00000  101.59200
   51    56    57    35.00000  120.00000
   51    56    61    63.00000  120.00000
   56    51    52    75.00000  120.00000
   56    61    42    70.00000  120.10000
   61    47    48    63.00000  120.00000
   61    56    57    35.00000  120.00000
   61    42    43    35.00000  113.50000
   42    39    40    35.00000  109.50000
   42    39    41    85.00000  107.56000
   53    50    51    65.00000  117.06700
   53    58    59    50.00000  110.93800
   53    58    60    50.00000  110.93800
   55    53    54   115.00000  120.17200
   58    53    54   115.00000  107.22500
   58    53    55   115.00000  107.22500
   60    58    59    35.00000  109.80100
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    34   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   33    39    41    44  -0.71500  1.0 1.0
   33    39    41    44  -0.42400 -1.0 2.0
   33    39    41    44   0.18500  1.0 3.0
   33    39    42    61  -0.12500  1.0 1.0
   33    39    42    61  -0.12500 -1.0 2.0
   33    39    42    61   0.25000  1.0 3.0
   33    39    42    43   0.00000  1.0 1.0
   34    33    39    40   0.27000  1.0 3.0
   34    33    39    41   0.56750  1.0 1.0
   34    33    39    41  -0.07550 -1.0 2.0
   34    33    39    41   0.20000  1.0 3.0
   34    33    39    42   1.15000  1.0 1.0
   34    33    39    42  -0.54150 -1.0 2.0
   34    33    39    42   0.79350  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    42   0.22950  1.0 3.0
   39    41    44    45  -0.30400  1.0 1.0
   39    41    44    45   0.50450 -1.0 2.0
   39    41    44    45   0.65550  1.0 3.0
   39    41    44    46  -0.30400  1.0 1.0
   39    41    44    46   0.50450 -1.0 2.0
   39    41    44    46   0.65550  1.0 3.0
   39    41    44    47  -0.64500  1.0 1.0
   39    41    44    47  -1.19050 -1.0 2.0
   39    41    44    47  -0.04400  1.0 3.0
   40    39    41    44   0.15000  1.0 3.0
   40    39    42    61   0.00000  1.0 1.0
   40    39    42    43   0.00000  1.0 1.0
   41    39    42    61  -0.12500  1.0 1.0
   41    39    42    61  -0.12500 -1.0 2.0
   41    39    42    61   0.25000  1.0 3.0
   41    39    42    43  -0.12500  1.0 1.0
   41    39    42    43  -0.12500 -1.0 2.0
   41    39    42    43   0.25000  1.0 3.0
   41    44    47    48  -0.49050  1.0 1.0
   41    44    47    48   0.22250 -1.0 2.0
   41    44    47    48  -0.39350  1.0 3.0
   41    44   -47    61  -0.49050  1.0 1.0
   41    44   -47    61   0.22250 -1.0 2.0
   41    44   -47    61  -0.39350  1.0 3.0
   44    47    48    49   3.62500 -1.0 2.0
   44    47    48    50   3.62500 -1.0 2.0
   44    47    61    56   3.62500 -1.0 2.0
   44    47    61    42   3.62500 -1.0 2.0
   45    44    47    48   0.19500  1.0 1.0
   45    44    47    48   0.12000 -1.0 2.0
   45    44    47    61   0.19500  1.0 1.0
   45    44    47    61   0.12000 -1.0 2.0
   46    44    47    48   0.19500  1.0 1.0
   46    44    47    48   0.12000 -1.0 2.0
   46    44    47    61   0.19500  1.0 1.0
   46    44    47    61   0.12000 -1.0 2.0
   47    48    50    51   3.62500 -1.0 2.0
   47    48    50    53   3.62500 -1.0 2.0
   47    61   -42    39  -1.00000  1.0 1.0
   47    61   -42    39   1.25000 -1.0 2.0
   47    61    42    43   1.00000 -1.0 2.0
   48    47    61    56   3.62500 -1.0 2.0
   48    47    61    42   3.62500 -1.0 2.0
   48    50    51    52   3.62500 -1.0 2.0
   48    50   -51    56   3.62500 -1.0 2.0
   48    50    53    54   0.19500  1.0 1.0
   48    50    53    54   0.12000 -1.0 2.0
   48    50    53    55   0.19500  1.0 1.0
   48    50    53    55   0.12000 -1.0 2.0
   48    50    53    58  -0.49050  1.0 1.0
   48    50    53    58   0.22250 -1.0 2.0
   48    50    53    58  -0.39350  1.0 3.0
   49    48    50    51   3.62500 -1.0 2.0
   49    48    50    53   3.62500 -1.0 2.0
   50    51    56    57   3.62500 -1.0 2.0
   50    51    56    61   3.62500 -1.0 2.0
   50    53    58    59   1.01100  1.0 1.0
   50    53    58    59  -0.22250 -1.0 2.0
   50    53    58    59   1.33750  1.0 3.0
   50    53    58    60   1.01100  1.0 1.0
   50    53    58    60  -0.22250 -1.0 2.0
   50    53    58    60   1.33750  1.0 3.0
   51    50    53    54   0.19500  1.0 1.0
   51    50    53    54   0.12000 -1.0 2.0
   51    50    53    55   0.19500  1.0 1.0
   51    50    53    55   0.12000 -1.0 2.0
   51    50    53    58  -0.49050  1.0 1.0
   51    50    53    58   0.22250 -1.0 2.0
   51    50    53    58  -0.39350  1.0 3.0
   51    56   -61    47   3.62500 -1.0 2.0
   51    56    61    42   3.62500 -1.0 2.0
   52    51    56    57   3.62500 -1.0 2.0
   52    51    56    61   3.62500 -1.0 2.0
   56    61    42    39  -1.00000  1.0 1.0
   56    61    42    39   1.25000 -1.0 2.0
   56    61    42    43   1.00000 -1.0 2.0
   57    56    61    47   3.62500 -1.0 2.0
   57    56    61    42   3.62500 -1.0 2.0
   61    47    48    49   3.62500 -1.0 2.0
   61    47   -48    50   3.62500 -1.0 2.0
   42    39   -41    44   0.00000  1.0 1.0
   53    50    51    52   3.62500 -1.0 2.0
   53    50    51    56   3.62500 -1.0 2.0
   54    53    58    59   1.12100  1.0 1.0
   54    53    58    59   0.54800 -1.0 2.0
   54    53    58    59  -0.29400  1.0 3.0
   54    53    58    60   1.12100  1.0 1.0
   54    53    58    60   0.54800 -1.0 2.0
   54    53    58    60  -0.29400  1.0 3.0
   55    53    58    59   1.12100  1.0 1.0
   55    53    58    59   0.54800 -1.0 2.0
   55    53    58    59  -0.29400  1.0 3.0
   55    53    58    60   1.12100  1.0 1.0
   55    53    58    60   0.54800 -1.0 2.0
   55    53    58    60  -0.29400  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
   37    30    36    38  10.50000 -1.0 2.0
   48    61    47    44   4.00000 -1.0 2.0
   50    49    48    47   1.10000 -1.0 2.0
   51    53    50    48   4.00000 -1.0 2.0
   56    52    51    50   4.00000 -1.0 2.0
   61    57    56    51   1.10000 -1.0 2.0
   56    42    61    47   4.00000 -1.0 2.0
   43    61    42    39   1.00000 -1.0 2.0
   60    53    58    59   1.00000 -1.0 2.0
END
