* LIGAND DATABASE FILE (OPLS2005)
*
001      63    65    114    177     329
    1     0 S   NP   _N1_     1    28.98689    92.53253   -21.75830
    2     1 S   H    _HN1     2     1.02813    20.59653   138.54738
    3     1 S   H    _H1_     3     1.02789    92.64619   -82.65407
    4     1 S   H    _H2_     4     1.03018    99.78920    26.23324
    5     1 S   CT   _CA1     5     1.50069   130.84253   154.32425
    6     5 S   HC   _HA1     6     1.09564   105.27714    51.80074
    7     5 S   CO3  _C1_     7     1.53809   112.21652   -68.51267
    8     7 S   O2Z  _O11     8     1.26375   115.02228   -44.60814
    9     7 S   O2Z  _O12     9     1.26245   114.90944   134.54597
   10     5 S   CT   _CB1    10     1.53054   107.53517   169.75894
   11    10 S   HC   HB11    11     1.09805   109.44282   -49.86229
   12    10 S   HC   HB12    12     1.09699   110.23845    66.79984
   13    10 S   CT   _CG1    13     1.53064   112.86808  -171.38208
   14    13 S   HC   HG11    14     1.09579   110.20402   -61.10585
   15    13 S   HC   HG12    15     1.09604   110.31885    58.13980
   16    13 S   C    _CD1    16     1.51810   111.85612   178.12978
   17    16 S   O    _OE1    17     1.22758   123.04606   -17.93098
   18    16 S   N    _N2_    18     1.38615   112.07560   163.07220
   19    18 S   H    _HN2    19     1.01575   119.21651     3.04915
   20    18 S   CT1  _CA2    20     1.46136   123.11972  -176.81353
   21    20 S   HC   _HA2    21     1.09580   109.07791    -3.88842
   22    20 S   C    _C2_    22     1.53342   109.01029  -119.18459
   23    22 S   O    _O2_    23     1.23036   122.11107  -146.08386
   24    20 S   CT   _CB2    32     1.53554   111.64811   118.05081
   25    24 S   HC   HB21    33     1.09653   109.53196    63.78781
   26    24 S   HC   HB22    34     1.09567   111.09836  -178.66675
   27    22 S   N    _N3_    24     1.38470   113.51110    41.55275
   28    27 S   H    _HN3    25     1.01493   119.00794    -0.66969
   29    24 S   S    _SG2    35     1.82825   114.04698   -55.47934
   30    27 S   CT   _CA3    26     1.45433   123.21723   174.43532
   31    30 S   HC   HA31    27     1.09541   108.90961    29.97395
   32    30 S   HC   HA32    28     1.09483   107.17251   146.99792
   33    29 S   CT   _C13    36     1.82509   100.17689   -74.35330
   34    33 S   HC   _H8_    37     1.09461   108.14892   -84.10496
   35    33 S   HC   _H9_    38     1.09303   109.78377    33.69221
   36    30 S   CO3  _C3_    29     1.52997   113.51329   -93.19068
   37    36 S   O2Z  _O31    30     1.26379   115.66572   -36.79246
   38    36 S   O2Z  _O32    31     1.26394   114.79387   144.13959
   39    33 S   CT   _C12    39     1.52355   109.56198   154.90754
   40    39 S   HC   _H5_    40     1.09467   113.67142    50.69616
   41    39 S   CO4  _C11    41     1.51027   111.53879   174.78665
   42    41 S   O    _O33    42     1.22439   124.38497   -63.73700
   43    41 S   CT   _C10    43     1.49604   111.56820   118.36000
   44    43 S   HC   _H4_    44     1.09239   113.47444  -139.82738
   45    43 S   CO   _C9_    45     1.52023    98.39968   -20.38113
   46    45 S   HC   _H3_    46     1.09820   110.48034   -81.59064
   47    43 S   OH   _O35    62     1.41243   107.25911    97.02359
   48    47 S   HO   _H10    63     0.97313   107.58619    69.01214
   49    45 S   N*   _N6_    47     1.44795   115.36554   156.64712
   50    39 S   OS   _O34    61     1.44156   110.98623   -72.07256
   51    49 S   CRAB _C8_    48     1.37188   124.18823    91.13220
   52    51 S   HA   _H7_    49     1.08193   122.42078    -0.87626
   53    51 S   NNA  _N7_    50     1.31534   112.15487   178.85500
   54    53 S   C56B _C6_    51     1.37439   104.90758    -0.07402
   55    49 S   C56A _C7_    52     1.36876   128.65716   -89.95054
   56    55 S   NB   _N5_    53     1.34229   128.32435     0.74572
   57    56 S   CQ   _C4_    54     1.34574   110.98342  -178.34164
   58    57 S   HA   _H6_    55     1.08491   115.81436   179.34121
   59    57 S   NB   _N4_    56     1.35364   128.55215    -0.35388
   60    54 S   CA   _C5_    57     1.40326   131.44585  -179.06791
   61    60 S   NND  _N8_    58     1.38122   122.21869    -0.20842
   62    61 S   H    _H11    59     1.01116   120.32891    -2.70146
   63    61 S   H    _H12    60     1.01040   119.38091  -178.06629
  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   9   5   9   6  11   5   3   1
   9   2   6   3   6   8   6   4   4   2   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    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    50  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    45    50  
   35    39    40    41    50  
   39    40    41    50  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    49    50    47  
   41    42    43    45    50  
   42    43    44    45    46    49    50    47    48  
   43    44    45    50    47  
   44    45    46    49    51    55    50    47    48  
   45    46    49    50    47    48  
   46    49    51    52    53    54    55    56    50    47    48  
   49    51    55    50    47  
   48    49    50  
    0  
   51    52    53    54    55    56    57    60    50  
   51    55  
   52    53    54    55    56    60  
   53    54    55  
   54    55    56    59    60    61  
   55    56    57    59    60    61    62    63  
   56    57    58    59    60    61  
   57    58    59    60  
   58    59    60    61  
   59    60  
   60    61    62    63  
   61    62    63  
   62    63  
   63  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   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   3.5000   0.0660   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.422000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   47   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   48   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.2500   0.1700  -0.500000   1.8000   1.6000   0.001000000  -0.511443539
   50   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   51   3.5000   0.0800   0.200000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   53   3.2500   0.1700  -0.490000   1.8000   1.6000   0.001000000  -0.511443539
   54   3.5000   0.0800   0.150000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.5000   0.0800   0.380000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.2500   0.1700  -0.550000   1.8000   1.6000   0.001000000  -0.511443539
   57   3.5000   0.0800   0.220000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   59   3.2500   0.1700  -0.530000   1.8000   1.6000   0.001000000  -0.511443539
   60   3.5000   0.0800   0.440000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.2500   0.1700  -0.810000   1.8650   1.6500   0.051222218  -2.220205820
   62   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   63   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
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   340.000  1.090
   33    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    50   320.000  1.410
   41    42   570.000  1.229
   41    43   317.000  1.522
   43    44   340.000  1.090
   43    45   250.000  1.527
   43    47   320.000  1.410
   45    46   340.000  1.090
   45    49   275.000  1.479
   45    50   320.000  1.380
   49    51   440.000  1.371
   49    55   436.000  1.374
   51    52   367.000  1.080
   51    53   529.000  1.304
   53    54   414.000  1.391
   54    55   447.000  1.419
   54    60   469.000  1.404
   55    56   461.000  1.354
   56    57   502.000  1.324
   57    58   367.000  1.080
   57    59   502.000  1.324
   59    60   483.000  1.339
   60    61   481.000  1.340
   61    62   434.000  1.010
   61    63   434.000  1.010
   47    48   553.000  0.945
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    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    50    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    43    70.00000  116.00000
   39    50    45    60.00000  109.50000
   41    39    40    35.00000  109.50000
   41    43    44    35.00000  109.50000
   41    43    45    63.00000  111.10000
   41    43    47    90.00000  109.61100
   43    41    42    80.00000  120.40000
   43    45    46    45.00000  112.01100
   43    45    49    75.00000  107.44000
   43    45    50    90.00000  108.56700
   43    47    48    55.00000  108.50000
   45    43    44    45.00000  108.72000
   45    49    51    70.00000  128.80000
   45    49    55    70.00000  125.80000
   49    45    46    55.00000  103.44000
   49    51    52    35.00000  123.05000
   49    51    53    70.00000  113.90000
   49    55    54    70.00000  106.20000
   49    55    56    70.00000  126.20000
   51    53    54    70.00000  103.80000
   53    51    52    35.00000  123.05000
   53    54    55    70.00000  110.40000
   53    54    60    70.00000  132.40000
   54    55    56    70.00000  127.70000
   54    60    59    70.00000  117.30000
   54    60    61    70.00000  123.50000
   55    49    51    70.00000  105.40000
   55    56    57    70.00000  111.00000
   56    57    58    35.00000  115.45000
   56    57    59    70.00000  129.10000
   57    59    60    70.00000  118.60000
   59    57    58    35.00000  115.45000
   59    60    61    70.00000  119.30000
   60    54    55    85.00000  116.20000
   60    61    62    35.00000  120.00000
   60    61    63    35.00000  120.00000
   63    61    62    35.00000  120.00000
   50    39    40    35.00000  109.50000
   50    39    41    90.00000  108.74100
   50    45    46    35.00000  109.50000
   50    45    49   105.00000  106.22000
   47    43    44    35.00000  109.50000
   47    43    45    90.00000  111.58700
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   0.32350  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    50   0.56750  1.0 1.0
   29    33    39    50  -0.07550 -1.0 2.0
   29    33    39    50   0.20000  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    43   0.60050  1.0 1.0
   33    39    41    43   0.05600 -1.0 2.0
   33    39    41    43   0.26150  1.0 3.0
   33    39    50    45   0.06250  1.0 1.0
   33    39    50    45  -0.01100 -1.0 2.0
   33    39    50    45   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    50   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    50   0.23400  1.0 3.0
   39    41    43    44   0.00000  1.0 1.0
   39    41   -43    45   0.60050  1.0 1.0
   39    41   -43    45   0.05600 -1.0 2.0
   39    41   -43    45   0.26150  1.0 3.0
   39    41    43    47   0.55300  1.0 1.0
   39    41    43    47   1.25850 -1.0 2.0
   39    41    43    47  -0.23600  1.0 3.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    50    45   0.37050  1.0 3.0
   41    39   -50    45  -1.11000  1.0 1.0
   41    39   -50    45   0.50250 -1.0 2.0
   41    39   -50    45   0.47450  1.0 3.0
   41    43    45    46  -0.11250  1.0 3.0
   41    43    45    49  -2.10200  1.0 1.0
   41    43    45    49  -0.31600 -1.0 2.0
   41    43    45    49   0.13050  1.0 3.0
   41    43   -45    50  -0.09450  1.0 1.0
   41    43   -45    50  -1.12950 -1.0 2.0
   41    43   -45    50   0.54000  1.0 3.0
   41    43    47    48   0.91850  1.0 1.0
   41    43    47    48   0.57950  1.0 3.0
   42    41    43    44   0.00000  1.0 1.0
   42    41    43    45   0.30150 -1.0 2.0
   42    41    43    47   0.30150 -1.0 2.0
   43    45    49    51   1.10250  1.0 1.0
   43    45    49    51   0.01650 -1.0 2.0
   43    45    49    51   0.39100  1.0 3.0
   43    45    49    55   1.10250  1.0 1.0
   43    45    49    55   0.01650 -1.0 2.0
   43    45    49    55   0.39100  1.0 3.0
   43    45   -50    39   0.06250  1.0 1.0
   43    45   -50    39  -0.01100 -1.0 2.0
   43    45   -50    39   0.28050  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    49   0.15000  1.0 3.0
   44    43    45    50   0.23400  1.0 3.0
   44    43    47    48   0.19450  1.0 3.0
   45    43    47    48  -0.11600  1.0 1.0
   45    43    47    48  -0.09450 -1.0 2.0
   45    43    47    48   0.21250  1.0 3.0
   45    49    51    52   3.62500 -1.0 2.0
   45    49    51    53   3.62500 -1.0 2.0
   45    49    55    54   0.81400  1.0 1.0
   45    49    55    54   1.55550 -1.0 2.0
   45    49    55    56   3.62500 -1.0 2.0
   46    45    49    51   0.00000  1.0 1.0
   46    45    49    55   0.00000  1.0 1.0
   46    45    50    39   0.37050  1.0 3.0
   49    45    50    39  -2.37750  1.0 1.0
   49    45    50    39  -0.08150 -1.0 2.0
   49    45    50    39   0.59000  1.0 3.0
   49    51   -53    54   3.62500 -1.0 2.0
   49    55    56    57   3.62500 -1.0 2.0
   51    49   -55    54   0.70250  1.0 1.0
   51    49   -55    54   1.56150 -1.0 2.0
   51    49    55    56   3.62500 -1.0 2.0
   51    53   -54    55   3.62500 -1.0 2.0
   51    53    54    60   3.62500 -1.0 2.0
   52    51    53    54   3.62500 -1.0 2.0
   53    54   -55    49   3.62500 -1.0 2.0
   53    54    55    56   3.62500 -1.0 2.0
   53    54    60    59   3.62500 -1.0 2.0
   53    54    60    61   3.62500 -1.0 2.0
   54    55    56    57   3.62500 -1.0 2.0
   54    60    61    62   0.70000 -1.0 2.0
   54    60    61    63   0.70000 -1.0 2.0
   55    49    51    52   3.62500 -1.0 2.0
   55    49   -51    53   3.62500 -1.0 2.0
   55    54    60    59   3.62500 -1.0 2.0
   55    54    60    61   3.62500 -1.0 2.0
   55    56    57    58   3.62500 -1.0 2.0
   55    56   -57    59   3.62500 -1.0 2.0
   56    57    59    60   3.62500 -1.0 2.0
   57    59   -60    54   3.62500 -1.0 2.0
   57    59    60    61   3.62500 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   59    60    61    62   0.70000 -1.0 2.0
   59    60    61    63   0.70000 -1.0 2.0
   60    54    55    49   3.00000 -1.0 2.0
   60    54   -55    56   3.62500 -1.0 2.0
   50    39    41    42   0.30150 -1.0 2.0
   50    39   -41    43   0.55300  1.0 1.0
   50    39   -41    43   1.25850 -1.0 2.0
   50    39   -41    43  -0.23600  1.0 3.0
   50    45    49    51   0.10350  1.0 1.0
   50    45    49    51  -0.15350 -1.0 2.0
   50    45    49    55   0.10350  1.0 1.0
   50    45    49    55  -0.15350 -1.0 2.0
   47    43    45    46   0.23400  1.0 3.0
   47    43    45    49   2.76900  1.0 1.0
   47    43    45    49  -0.24350 -1.0 2.0
   47    43    45    49  -0.78250  1.0 3.0
   47    43    45    50   3.69350  1.0 1.0
   47    43    45    50  -1.82950 -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
   37    30    36    38  10.50000 -1.0 2.0
   39    43    41    42  10.50000 -1.0 2.0
   51    55    49    45   4.00000 -1.0 2.0
   53    52    51    49   1.10000 -1.0 2.0
   55    60    54    53   4.00000 -1.0 2.0
   54    56    55    49   4.00000 -1.0 2.0
   59    58    57    56   1.10000 -1.0 2.0
   59    61    60    54   4.00000 -1.0 2.0
   63    60    61    62   1.00000 -1.0 2.0
END
