* LIGAND DATABASE FILE (OPLS2005)
*
001      70    72    129    206     382
    1     0 S   NP   _N1_     1    28.79557    95.75454   -20.64634
    2     1 S   H    _HN1     2     1.02776    83.82487   -97.78546
    3     1 S   H    _H1_     3     1.02953    85.34936    11.25776
    4     1 S   H    _H2_     4     1.02833    40.17493   134.84640
    5     1 S   CT   _CA1     5     1.50136   150.90224   136.24691
    6     5 S   HC   _HA1     6     1.09550   105.30813    58.52708
    7     5 S   CO3  _C1_     7     1.53991   112.12644   -62.03990
    8     7 S   O2Z  _O11     8     1.26422   114.98782   -44.45991
    9     7 S   O2Z  _O12     9     1.26204   115.05819   134.45917
   10     5 S   CT   _CB1    10     1.53093   107.42647   176.86593
   11    10 S   HC   HB11    11     1.09816   110.05480   -45.31960
   12    10 S   HC   HB12    12     1.09825   110.06872    71.40187
   13    10 S   CT   _CG1    13     1.53011   112.44956  -166.17600
   14    13 S   HC   HG11    14     1.09509   110.34402   -53.37780
   15    13 S   HC   HG12    15     1.09612   110.12454    65.70634
   16    13 S   C    _CD1    16     1.51783   112.12635  -173.44124
   17    16 S   O    _OE1    17     1.22758   123.18813    -5.08203
   18    16 S   N    _N2_    18     1.38513   111.73809   174.08242
   19    18 S   H    _HN2    19     1.02034   119.18563     4.04748
   20    18 S   CT1  _CA2    20     1.46134   123.42615  -172.08203
   21    20 S   HC   _HA2    21     1.09724   109.22025    -8.35595
   22    20 S   C    _C2_    22     1.53352   109.60200  -124.53692
   23    22 S   O    _O2_    23     1.23074   121.92139  -152.39794
   24    20 S   CT   _CB2    32     1.53654   110.88382   112.93610
   25    24 S   HC   HB21    33     1.09399   109.35048    61.24843
   26    24 S   HC   HB22    34     1.09510   110.56007   179.34988
   27    22 S   N    _N3_    24     1.38415   113.67608    35.42239
   28    27 S   H    _HN3    25     1.01515   118.78314    -2.19811
   29    24 S   S    _SG2    35     1.83167   111.21024   -61.17645
   30    27 S   CT   _CA3    26     1.45428   123.57758   174.96561
   31    30 S   HC   HA31    27     1.09520   109.31451    22.70152
   32    30 S   HC   HA32    28     1.09500   107.10442   139.67576
   33    29 S   CT   _C5_    36     1.85700   101.29304   146.26317
   34    30 S   CO3  _C3_    29     1.52916   113.07712  -100.85066
   35    34 S   O2Z  _O31    30     1.26416   115.41484   -45.86452
   36    34 S   O2Z  _O32    31     1.26371   115.03120   135.10365
   37    33 S   CT   _C6_    37     1.56030   111.41069  -169.24166
   38    37 S   HC   _H3_    38     1.10124   108.42987  -170.79681
   39    33 S   OS   _O35    60     1.44938   113.24402   -45.61783
   40    33 S   CT   _C4_    67     1.53749   107.22279    69.04244
   41    40 S   HC   _H5_    68     1.09668   111.42808   -68.77181
   42    40 S   HC   _H6_    69     1.09684   110.28754   174.54102
   43    40 S   HC   _H7_    70     1.09403   113.30287    53.41420
   44    37 S   CO4  _C15    39     1.53333   114.54371   -54.20815
   45    44 S   O    _O33    40     1.22988   121.10936   -64.46377
   46    44 S   CA   _C14    41     1.49028   119.67621   115.97579
   47    46 S   CA   _C9_    42     1.40254   119.05327     8.31786
   48    47 S   CA   _C10    43     1.40319   119.54385   179.89165
   49    48 S   HA   _H9_    44     1.08841   120.64035   179.78150
   50    47 S   CM   _C8_    52     1.45939   121.63394    -0.16786
   51    50 S   HC   _H8_    53     1.08590   118.22799   177.49892
   52    48 S   CA   _C11    45     1.39427   120.61093    -0.02798
   53    52 S   HA   _H10    46     1.08621   120.00207   179.89913
   54    37 S   CM   _C7_    54     1.50817   109.91445    74.87800
   55    52 S   CA   _C12    47     1.39132   119.92750    -0.06561
   56    55 S   HA   _H11    48     1.08673   119.69423   179.97202
   57    54 S   CT   _C16    55     1.50281   113.14383    54.55433
   58    57 S   HC   _H13    56     1.09719   108.61985    63.25989
   59    57 S   HC   _H14    57     1.09620   111.73148  -178.27490
   60    46 S   CA   _C13    49     1.40427   121.58758  -171.92542
   61    57 S   CT   _C17    58     1.53001   108.00584   -56.79822
   62    61 S   HC   _H4_    59     1.09419   109.60809   -63.32594
   63    60 S   OH   _O34    50     1.36908   123.49479     0.34378
   64    63 S   HO   _H12    51     0.97379   108.75728    -1.64806
   65    61 S   CT   _C18    61     1.52836   110.47548   175.68988
   66    65 S   HC   _H15    62     1.09654   110.66292    49.05778
   67    65 S   HC   _H16    63     1.09690   110.38162   -70.31083
   68    65 S   CO3  _C19    64     1.53067   111.14232   168.09022
   69    68 S   O2Z  _O37    65     1.26377   115.56659   -57.35524
   70    68 S   O2Z  _O36    66     1.26330   114.95146   123.77819
  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  11   5   4   3
  16   2   1   1  18   8  15   6   2   1   1  10   4  12  11   9
   4   8   2   5   3   6   4   2   8   4   3   2   7   4   1   1
   5   4   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    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    54    61    39    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    44    45    46    50    54    57    61    62    39    65    40    41    42    43  
   35    36  
   36  
    0  
   38    44    45    46    47    60    50    51    54    57    58    59    61    39    40    41    42    43  
   44    45    46    50    54    57    39    40  
   65    66    67    68    40    41    42    43    44    54    57    58    59    61    62  
   41    42    43    44    54    61  
   42    43  
   43  
    0  
   45    46    47    48    55    60    63    50    54    57  
   46    47    60    54  
   47    48    49    52    55    56    60    63    64    50    51    54  
   48    49    52    53    55    60    63    50    51    54    57  
   49    52    53    55    56    60    50    51    54  
   52    53    55    50  
   51    54    57    58    59    61    52    60  
   54    57  
   53    55    56    60    63  
   55    56    60  
   57    58    59    61    62    65  
   56    60    63    64  
   60    63  
   58    59    61    62    65    66    67    68  
   59    61    62    65  
   61    62    65  
   63    64  
   62    65    66    67    68    69    70  
   65    66    67    68  
   64  
    0  
   66    67    68    69    70  
   67    68    69    70  
   68    69    70  
   69    70  
   70  
    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  -0.316400   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   0.348900   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.000000   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   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   68   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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    39   320.000  1.410
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    44   317.000  1.522
   37    54   317.000  1.510
   44    45   570.000  1.229
   44    46   310.000  1.470
   46    47   469.000  1.400
   46    60   469.000  1.400
   47    48   469.000  1.400
   47    50   320.000  1.460
   48    49   367.000  1.080
   48    52   469.000  1.400
   52    53   367.000  1.080
   52    55   469.000  1.400
   55    56   367.000  1.080
   55    60   469.000  1.400
   60    63   450.000  1.364
   63    64   553.000  0.945
   50    51   340.000  1.080
   50    54   549.000  1.340
   54    57   317.000  1.510
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    61   268.000  1.529
   61    62   340.000  1.090
   61    39   320.000  1.410
   61    65   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   317.000  1.522
   68    69   656.000  1.250
   68    70   656.000  1.250
   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    39    85.00000  114.68000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    44    63.00000  111.10000
   33    37    54    70.00000  112.02700
   33    39    61    60.00000  109.50000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    80.00000  120.40000
   37    44    46    65.00000  115.47100
   37    54    50    70.00000  124.00000
   37    54    57    65.00000  117.92700
   44    37    38    35.00000  109.50000
   44    46    47    60.00000  119.52600
   44    46    60    60.00000  119.52600
   46    44    45    75.00000  123.78400
   46    47    48    63.00000  120.00000
   46    47    50    60.00000  120.93500
   46    60    55    63.00000  120.00000
   46    60    63    70.00000  120.00000
   47    48    49    35.00000  120.00000
   47    48    52    63.00000  120.00000
   47    50    51    40.00000  117.26300
   47    50    54    60.00000  123.20500
   48    52    53    35.00000  120.00000
   48    52    55    63.00000  120.00000
   52    48    49    35.00000  120.00000
   52    55    56    35.00000  120.00000
   52    55    60    63.00000  120.00000
   55    52    53    35.00000  120.00000
   55    60    63    70.00000  120.00000
   60    46    47    63.00000  120.00000
   60    55    56    35.00000  120.00000
   60    63    64    35.00000  113.00000
   50    47    48    60.00000  120.93500
   50    54    57    70.00000  124.00000
   54    37    38    35.00000  109.50000
   54    37    44    70.00000  109.06800
   54    50    51    35.00000  120.00000
   54    57    58    35.00000  109.50000
   54    57    59    35.00000  109.50000
   54    57    61    70.00000  112.02700
   57    61    62    37.50000  110.70000
   57    61    39    50.00000  109.50000
   57    61    65    58.35000  112.70000
   59    57    58    33.00000  107.80000
   61    57    58    37.50000  110.70000
   61    57    59    37.50000  110.70000
   61    65    66    37.50000  110.70000
   61    65    67    37.50000  110.70000
   61    65    68    70.00000  109.69300
   39    33    37    50.00000  109.50000
   39    61    62    35.00000  109.50000
   65    61    62    37.50000  110.70000
   65    61    39    50.00000  109.50000
   65    68    69    70.00000  117.00000
   65    68    70    70.00000  117.00000
   67    65    66    33.00000  107.80000
   68    65    66    35.00000  109.50000
   68    65    67    35.00000  109.50000
   70    68    69    80.00000  126.00000
   40    33    37    58.35000  112.70000
   40    33    39    50.00000  109.50000
   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    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  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    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    37    54   0.56750  1.0 1.0
   29    33    37    54  -0.07550 -1.0 2.0
   29    33    37    54   0.20000  1.0 3.0
   29    33    39    61   0.14700  1.0 1.0
   29    33    39    61  -1.16150 -1.0 2.0
   29    33    39    61   0.48700  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   0.30150 -1.0 2.0
   33    37    44    46   0.05850 -1.0 2.0
   33    37    44    46   0.17250  1.0 3.0
   33    37    54    50   0.09850  1.0 1.0
   33    37    54    50   0.15250 -1.0 2.0
   33    37    54    50  -0.50650  1.0 3.0
   33    37    54    57   0.46850  1.0 1.0
   33    37    54    57   0.08550 -1.0 2.0
   33    37    54    57   0.09800  1.0 3.0
   37    33    39    61   0.06250  1.0 1.0
   37    33    39    61  -0.01100 -1.0 2.0
   37    33    39    61   0.28050  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    46    47   2.26350  1.0 1.0
   37    44    46    47   0.76750 -1.0 2.0
   37    44    46    47   0.22500  1.0 3.0
   37    44    46    60   2.26350  1.0 1.0
   37    44    46    60   0.76750 -1.0 2.0
   37    44    46    60   0.22500  1.0 3.0
   37    54    57    58   0.34800  1.0 3.0
   37    54    57    59   0.34800  1.0 3.0
   37    54   -57    61   0.46850  1.0 1.0
   37    54   -57    61   0.08550 -1.0 2.0
   37    54   -57    61   0.09800  1.0 3.0
   38    37    44    45   0.00000  1.0 1.0
   38    37    44    46   0.00000  1.0 1.0
   38    37    54    50   0.00000  1.0 1.0
   38    37    54    57   0.34800  1.0 3.0
   44    37    54    50  -0.51250  1.0 1.0
   44    37    54    50  -0.88800 -1.0 2.0
   44    37    54    50   0.08850  1.0 3.0
   44    37    54    57   0.17250  1.0 1.0
   44    37    54    57  -0.04100 -1.0 2.0
   44    37    54    57  -0.33850  1.0 3.0
   44    46    47    48   3.62500 -1.0 2.0
   44    46   -47    50   3.62500 -1.0 2.0
   44    46    60    55   3.62500 -1.0 2.0
   44    46    60    63   3.62500 -1.0 2.0
   45    44    46    47   1.05000 -1.0 2.0
   45    44    46    60   1.05000 -1.0 2.0
   46    47    48    49   3.62500 -1.0 2.0
   46    47    48    52   3.62500 -1.0 2.0
   46    47    50    51   0.56550  1.0 3.0
   46    47    50    54   0.15800  1.0 1.0
   46    47    50    54   1.85350 -1.0 2.0
   46    47    50    54  -0.48700  1.0 3.0
   46    60    63    64   0.84100 -1.0 2.0
   47    46    60    55   3.62500 -1.0 2.0
   47    46    60    63   3.62500 -1.0 2.0
   47    48    52    53   3.62500 -1.0 2.0
   47    48   -52    55   3.62500 -1.0 2.0
   47    50   -54    37   7.00000 -1.0 2.0
   47    50    54    57   7.00000 -1.0 2.0
   48    47    50    51   0.56550  1.0 3.0
   48    47    50    54   0.15800  1.0 1.0
   48    47    50    54   1.85350 -1.0 2.0
   48    47    50    54  -0.48700  1.0 3.0
   48    52    55    56   3.62500 -1.0 2.0
   48    52    55    60   3.62500 -1.0 2.0
   49    48    52    53   3.62500 -1.0 2.0
   49    48    52    55   3.62500 -1.0 2.0
   52    55   -60    46   3.62500 -1.0 2.0
   52    55    60    63   3.62500 -1.0 2.0
   53    52    55    56   3.62500 -1.0 2.0
   53    52    55    60   3.62500 -1.0 2.0
   55    60    63    64   0.84100 -1.0 2.0
   56    55    60    46   3.62500 -1.0 2.0
   56    55    60    63   3.62500 -1.0 2.0
   60    46   -47    48   3.62500 -1.0 2.0
   60    46    47    50   3.62500 -1.0 2.0
   50    47    48    49   3.62500 -1.0 2.0
   50    47    48    52   3.62500 -1.0 2.0
   50    54    57    58   0.00000  1.0 1.0
   50    54    57    59   0.00000  1.0 1.0
   50    54    57    61   0.09850  1.0 1.0
   50    54    57    61   0.15250 -1.0 2.0
   50    54    57    61  -0.50650  1.0 3.0
   51    50    54    37   7.00000 -1.0 2.0
   51    50    54    57   7.00000 -1.0 2.0
   54    37    44    45   0.30150 -1.0 2.0
   54    37   -44    46   0.65300  1.0 1.0
   54    37   -44    46  -0.03850 -1.0 2.0
   54    37   -44    46   0.33900  1.0 3.0
   54    57    61    62   0.15000  1.0 3.0
   54    57    61    39   0.61850  1.0 1.0
   54    57    61    39  -0.22750 -1.0 2.0
   54    57    61    39   0.15300  1.0 3.0
   54    57    61    65   0.34400  1.0 1.0
   54    57    61    65   0.09450 -1.0 2.0
   54    57    61    65   0.11100  1.0 3.0
   57    61   -39    33   0.06250  1.0 1.0
   57    61   -39    33  -0.01100 -1.0 2.0
   57    61   -39    33   0.28050  1.0 3.0
   57    61    65    66   0.15000  1.0 3.0
   57    61    65    67   0.15000  1.0 3.0
   57    61    65    68  -1.63150  1.0 1.0
   57    61    65    68  -0.43550 -1.0 2.0
   57    61    65    68   0.24500  1.0 3.0
   58    57    61    62   0.15000  1.0 3.0
   58    57    61    39   0.23400  1.0 3.0
   58    57    61    65   0.15000  1.0 3.0
   59    57    61    62   0.15000  1.0 3.0
   59    57    61    39   0.23400  1.0 3.0
   59    57    61    65   0.15000  1.0 3.0
   61    65    68    69   0.41150 -1.0 2.0
   61    65    68    70   0.41150 -1.0 2.0
   62    61    39    33   0.37050  1.0 3.0
   62    61    65    66   0.15000  1.0 3.0
   62    61    65    67   0.15000  1.0 3.0
   62    61    65    68  -0.11250  1.0 3.0
   39    33    37    38   0.23400  1.0 3.0
   39    33    37    44  -0.09450  1.0 1.0
   39    33    37    44  -1.12950 -1.0 2.0
   39    33    37    44   0.54000  1.0 3.0
   39    33   -37    54   0.61850  1.0 1.0
   39    33   -37    54  -0.22750 -1.0 2.0
   39    33   -37    54   0.15300  1.0 3.0
   39    33    40    41   0.23400  1.0 3.0
   39    33    40    42   0.23400  1.0 3.0
   39    33    40    43   0.23400  1.0 3.0
   39    61    65    66   0.23400  1.0 3.0
   39    61    65    67   0.23400  1.0 3.0
   39    61    65    68  -3.35100  1.0 1.0
   39    61    65    68  -0.37050 -1.0 2.0
   39    61    65    68   0.22400  1.0 3.0
   65    61    39    33   0.06250  1.0 1.0
   65    61    39    33  -0.01100 -1.0 2.0
   65    61    39    33   0.28050  1.0 3.0
   66    65    68    69   0.00000  1.0 1.0
   66    65    68    70   0.00000  1.0 1.0
   67    65    68    69   0.00000  1.0 1.0
   67    65    68    70   0.00000  1.0 1.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    44  -0.95700  1.0 1.0
   40    33    37    44  -0.18200 -1.0 2.0
   40    33    37    44   0.29450  1.0 3.0
   40    33    37    54   0.34400  1.0 1.0
   40    33    37    54   0.09450 -1.0 2.0
   40    33    37    54   0.11100  1.0 3.0
   40    33    39    61   0.06250  1.0 1.0
   40    33    39    61  -0.01100 -1.0 2.0
   40    33    39    61   0.28050  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    46    44    45  10.50000 -1.0 2.0
   47    60    46    44   4.00000 -1.0 2.0
   48    50    47    46   4.00000 -1.0 2.0
   52    49    48    47   1.10000 -1.0 2.0
   55    53    52    48   1.10000 -1.0 2.0
   60    56    55    52   1.10000 -1.0 2.0
   55    63    60    46   4.00000 -1.0 2.0
   47    51    50    54   1.10000 -1.0 2.0
   37    57    54    50   1.10000 -1.0 2.0
   69    65    68    70  10.50000 -1.0 2.0
END
