* LIGAND DATABASE FILE (OPLS2005)
*
001      61    62    110    167     319
    1     0 S   NP   _N1_     1    29.24358    97.40803   -21.07586
    2     1 S   H    _HN1     2     1.02944    65.38871    12.24946
    3     1 S   H    _H1_     3     1.02825    47.34169   161.76267
    4     1 S   H    _H2_     4     1.02797   100.37548   -93.37685
    5     1 S   CT   _CA1     5     1.50101   146.18634   102.56077
    6     5 S   HC   _HA1     6     1.09565   105.19284   101.82391
    7     5 S   CO3  _C1_     7     1.53706   112.43731   -18.55465
    8     7 S   O2Z  _O11     8     1.26364   114.86897   -43.02908
    9     7 S   O2Z  _O12     9     1.26193   114.95081   136.00650
   10     5 S   CT   _CB1    10     1.53031   107.43291  -140.02870
   11    10 S   HC   HB11    11     1.09845   109.45255   -48.41975
   12    10 S   HC   HB12    12     1.09808   110.50614    68.25348
   13    10 S   CT   _CG1    13     1.52981   112.49819  -169.24104
   14    13 S   HC   HG11    14     1.09430   110.85668   -67.85190
   15    13 S   HC   HG12    15     1.09653   109.55878    51.23671
   16    13 S   C    _CD1    16     1.51781   111.58349   172.08185
   17    16 S   O    _OE1    17     1.22767   123.01660    22.47382
   18    16 S   N    _N2_    18     1.38512   112.00377  -157.80534
   19    18 S   H    _HN2    19     1.01609   118.82266     0.64710
   20    18 S   CT1  _CA2    20     1.46148   123.53829   174.67715
   21    20 S   HC   _HA2    21     1.09731   109.45621     4.29660
   22    20 S   C    _C2_    22     1.53670   108.23763  -110.91115
   23    22 S   O    _O2_    23     1.23051   122.34891  -147.57692
   24    20 S   CT   _CB2    32     1.53193   111.56319   126.71894
   25    24 S   HC   HB21    33     1.09550   110.37219    54.30043
   26    24 S   HC   HB22    34     1.09526   110.44602   172.36946
   27    22 S   N    _N3_    24     1.38351   113.67203    39.88339
   28    27 S   H    _HN3    25     1.01561   119.55682    -3.08178
   29    24 S   S    _SG2    35     1.82912   111.78483   -69.36547
   30    27 S   CT   _CA3    26     1.45271   123.38021   177.38701
   31    30 S   HC   HA31    27     1.09543   107.51525   -65.40361
   32    30 S   HC   HA32    28     1.09554   108.01298    51.08154
   33    29 S   CT   _C11    36     1.83759    99.86231   127.71776
   34    33 S   Cl   Cl2_    37     1.80104   108.09058   157.44983
   35    33 S   HC   _H4_    38     1.09528   108.09223    43.91722
   36    30 S   CO3  _C3_    29     1.52999   113.97242   173.11855
   37    36 S   O2Z  _O31    30     1.26397   116.07020     0.86818
   38    36 S   O2Z  _O32    31     1.26419   114.42807  -179.08785
   39    33 S   CT   _C10    39     1.55171   112.13971   -78.67703
   40    39 S   HC   _H3_    40     1.09791   107.30794    51.86061
   41    39 S   NM   _N5_    41     1.47077   109.35285   170.49811
   42    39 S   NE   _N6_    54     1.46453   110.20419   -65.12809
   43    42 S   H    _H9_    55     1.01413   118.00956    30.51462
   44    41 S   SY   _S2_    42     1.59585   111.23484  -174.21887
   45    44 S   OY   _O35    43     1.46014   113.72464  -160.03636
   46    44 S   OY   _O36    44     1.46026   115.32593    63.12820
   47    44 S   CA   _C6_    45     1.79405   105.49636   -48.25346
   48    47 S   CA   _C7_    46     1.39564   119.41466  -159.32387
   49    48 S   HA   _H6_    47     1.08548   119.61125    -3.33043
   50    48 S   CA   _C8_    48     1.39604   118.90030   176.22192
   51    50 S   CA   _C9_    49     1.40079   119.91124     0.04846
   52    51 S   Cl   Cl1_    50     1.72887   123.53779  -178.25718
   53    50 S   SY   _S1_    56     1.77281   118.01633  -179.95154
   54    53 S   OY   _O33    57     1.44804   108.12729  -131.01291
   55    53 S   OY   _O34    58     1.45000   108.38278     1.39002
   56    51 S   CA   _C4_    51     1.40427   119.74589     0.41069
   57    56 S   HA   _H5_    52     1.08906   119.53376  -179.69610
   58    53 S   NS   _N4_    59     1.70301   101.14164   114.09898
   59    58 S   H    _H7_    60     1.02590   116.43548   109.89932
   60    58 S   H    _H8_    61     1.02573   116.50220  -110.73222
   61    47 S   CA   _C5_    53     1.39682   117.63561    17.99844
  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
