* LIGAND DATABASE FILE (OPLS2005)
*
001      57    58     98    155     287
    1     0 S   NP   _N1_     1    28.93961    94.54231   -23.34291
    2     1 S   H    _HN1     2     1.02960    86.48623     3.57248
    3     1 S   H    _H1_     3     1.02840    24.28484   151.76476
    4     1 S   H    _H2_     4     1.02777   103.41937  -104.44953
    5     1 S   CT   _CA1     5     1.50117   131.89399   118.04512
    6     5 S   HC   _HA1     6     1.09573   105.23869    73.33950
    7     5 S   CO3  _C1_     7     1.53779   112.35570   -46.90175
    8     7 S   O2Z  _O11     8     1.26360   114.99538   -44.51366
    9     7 S   O2Z  _O12     9     1.26232   114.92506   134.63906
   10     5 S   CT   _CB1    10     1.53085   107.43872  -168.73318
   11    10 S   HC   HB11    11     1.09835   109.35692   -50.65579
   12    10 S   HC   HB12    12     1.09825   110.42309    65.87108
   13    10 S   CT   _CG1    13     1.53051   112.67675  -171.74631
   14    13 S   HC   HG11    14     1.09587   110.52556   -63.79973
   15    13 S   HC   HG12    15     1.09645   109.97569    55.50338
   16    13 S   C    _CD1    16     1.51731   112.14438   175.85027
   17    16 S   O    _OE1    17     1.22739   123.22900    -0.24389
   18    16 S   N    _N2_    18     1.38559   111.94584   179.61641
   19    18 S   H    _HN2    19     1.01600   119.15435     3.98610
   20    18 S   CT1  _CA2    20     1.45759   122.59920   178.17930
   21    20 S   HC   _HA2    21     1.09408   109.82654    16.64379
   22    20 S   C    _C2_    22     1.52599   105.16916   -99.83565
   23    22 S   O    _O2_    23     1.22915   122.49409   -83.98740
   24    20 S   CT   _CB2    32     1.53152   111.86930   139.84462
   25    24 S   HC   HB21    33     1.09628   110.35048    52.37847
   26    24 S   HC   HB22    34     1.09581   110.70573   170.31184
   27    22 S   N    _N3_    24     1.38570   112.49825    92.14180
   28    27 S   H    _HN3    25     1.01514   119.52053     2.18050
   29    24 S   S    _SG2    35     1.83298   112.74423   -66.86532
   30    27 S   CT   _CA3    26     1.45401   123.28443   177.59263
   31    30 S   HC   HA31    27     1.09513   109.20375    25.87032
   32    30 S   HC   HA32    28     1.09487   107.13343   143.09541
   33    29 S   CA   _C12    36     1.79208    99.50508   -76.91357
   34    30 S   CO3  _C3_    29     1.53033   113.21747   -97.35111
   35    34 S   O2Z  _O31    30     1.26404   115.65127   -36.19021
   36    34 S   O2Z  _O32    31     1.26376   114.81550   144.62259
   37    33 S   CA   _C11    37     1.40218   117.71812    91.87412
   38    37 S   HA   _H6_    38     1.08859   119.98342     1.45145
   39    37 S   CA   _C10    39     1.39999   120.59444  -177.41646
   40    39 S   CA   _C15    40     1.39527   119.97511    -3.74293
   41    40 S   Cl   Cl3_    41     1.72544   121.22125  -178.42170
   42    39 S   OS   _O33    46     1.37855   120.62809   178.61831
   43    40 S   CA   _C14    42     1.39531   119.91223     2.38499
   44    43 S   HA   _H7_    43     1.08810   119.88790   179.45285
   45    42 S   CA   _C6_    47     1.38026   116.03127   -56.56123
   46    33 S   CA   _C13    44     1.40412   123.40890   -88.39004
   47    46 S   Cl   Cl4_    45     1.73080   122.22849    -0.53376
   48    45 S   CA   _C5_    48     1.40067   121.12520   -53.64873
   49    48 S   HA   _H4_    49     1.08675   121.05653     0.95552
   50    48 S   CA   _C4_    50     1.39499   119.99256  -178.84597
   51    50 S   HA   _H3_    51     1.08710   119.34733  -179.41349
   52    50 S   CA   _C9_    52     1.39448   119.76206     0.60813
   53    52 S   Cl   Cl1_    53     1.72206   119.64278  -179.26885
   54    52 S   CA   _C8_    54     1.39551   120.65736     0.66175
   55    54 S   HA   _H5_    55     1.08718   120.17172   179.70195
   56    45 S   CA   _C7_    56     1.39916   118.94130   129.31289
   57    56 S   Cl   Cl2_    57     1.72613   121.14101    -2.05252
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   7   5   4   3
   9   2   1   1   9   4   9   7   4   8   3   2   9   1   1   8
   4   6   3   5   3   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    46    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    43    46    47  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    43    44    46    47    42  
   35    36  
   36  
    0  
   38    39    40    41    43    46    47    42    45  
   39    40    46    42  
   40    41    43    44    46    42    45    48    56  
   41    43    44    46    47    42    45  
   43    44    46    42  
   45    48    49    50    54    56    57    43  
   44    46    47  
   46    47  
   48    49    50    51    52    54    55    56    57  
   47  
    0  
   49    50    51    52    53    54    56    57  
   50    51    52    56  
   51    52    53    54    55    56  
   52    53    54  
   53    54    55    56    57  
   54    55    56  
   55    56    57  
   56    57  
   57  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.320000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5500   0.0700   0.152500   2.5000   1.7750   0.001000000  -0.843144165
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   38   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   39   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   42   2.9000   0.1400  -0.170000   1.7660   1.5600   0.020110767  -0.896042159
   43   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   44   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   45   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   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  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   250.000  1.760
   33    37   469.000  1.400
   33    46   469.000  1.400
   37    38   367.000  1.080
   37    39   469.000  1.400
   39    40   469.000  1.400
   39    42   450.000  1.364
   40    41   300.000  1.725
   40    43   469.000  1.400
   43    44   367.000  1.080
   43    46   469.000  1.400
   46    47   300.000  1.725
   42    45   450.000  1.364
   45    48   469.000  1.400
   45    56   469.000  1.400
   48    49   367.000  1.080
   48    50   469.000  1.400
   50    51   367.000  1.080
   50    52   469.000  1.400
   52    53   300.000  1.725
   52    54   469.000  1.400
   54    55   367.000  1.080
   54    56   469.000  1.400
   56    57   300.000  1.725
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    46    85.00000  119.40000
   33    37    38    35.00000  120.00000
   33    37    39    63.00000  120.00000
   33    46    43    63.00000  120.00000
   33    46    47    75.00000  120.00000
   37    39    40    63.00000  120.00000
   37    39    42    70.00000  120.00000
   39    37    38    35.00000  120.00000
   39    40    41    75.00000  120.00000
   39    40    43    63.00000  120.00000
   39    42    45    85.00000  114.70000
   40    43    44    35.00000  120.00000
   40    43    46    63.00000  120.00000
   43    40    41    75.00000  120.00000
   43    46    47    75.00000  120.00000
   46    33    37    63.00000  120.00000
   46    43    44    35.00000  120.00000
   42    39    40    70.00000  120.00000
   42    45    48    70.00000  120.00000
   42    45    56    70.00000  120.00000
   45    48    49    35.00000  120.00000
   45    48    50    63.00000  120.00000
   45    56    54    63.00000  120.00000
   45    56    57    75.00000  120.00000
   48    50    51    35.00000  120.00000
   48    50    52    63.00000  120.00000
   50    48    49    35.00000  120.00000
   50    52    53    75.00000  120.00000
   50    52    54    63.00000  120.00000
   52    50    51    35.00000  120.00000
   52    54    55    35.00000  120.00000
   52    54    56    63.00000  120.00000
   54    52    53    75.00000  120.00000
   54    56    57    75.00000  120.00000
   56    45    48    63.00000  120.00000
   56    54    55    35.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.63250 -1.0 2.0
   24    29    33    46   0.63250 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   3.62500 -1.0 2.0
   29    33    37    39   3.62500 -1.0 2.0
   29    33    46    43   3.62500 -1.0 2.0
   29    33    46    47   3.62500 -1.0 2.0
   33    37    39    40   3.62500 -1.0 2.0
   33    37    39    42   3.62500 -1.0 2.0
   37    33    46    43   3.62500 -1.0 2.0
   37    33    46    47   3.62500 -1.0 2.0
   37    39    40    41   3.62500 -1.0 2.0
   37    39   -40    43   3.62500 -1.0 2.0
   37    39    42    45   0.47150 -1.0 2.0
   38    37    39    40   3.62500 -1.0 2.0
   38    37    39    42   3.62500 -1.0 2.0
   39    40    43    44   3.62500 -1.0 2.0
   39    40    43    46   3.62500 -1.0 2.0
   39    42    45    48   0.47150 -1.0 2.0
   39    42    45    56   0.47150 -1.0 2.0
   40    39    42    45   0.47150 -1.0 2.0
   40    43   -46    33   3.62500 -1.0 2.0
   40    43    46    47   3.62500 -1.0 2.0
   41    40    43    44   3.62500 -1.0 2.0
   41    40    43    46   3.62500 -1.0 2.0
   44    43    46    33   3.62500 -1.0 2.0
   44    43    46    47   3.62500 -1.0 2.0
   46    33    37    38   3.62500 -1.0 2.0
   46    33   -37    39   3.62500 -1.0 2.0
   42    39    40    41   3.62500 -1.0 2.0
   42    39    40    43   3.62500 -1.0 2.0
   42    45    48    49   3.62500 -1.0 2.0
   42    45    48    50   3.62500 -1.0 2.0
   42    45    56    54   3.62500 -1.0 2.0
   42    45    56    57   3.62500 -1.0 2.0
   45    48    50    51   3.62500 -1.0 2.0
   45    48    50    52   3.62500 -1.0 2.0
   48    45    56    54   3.62500 -1.0 2.0
   48    45    56    57   3.62500 -1.0 2.0
   48    50    52    53   3.62500 -1.0 2.0
   48    50   -52    54   3.62500 -1.0 2.0
   49    48    50    51   3.62500 -1.0 2.0
   49    48    50    52   3.62500 -1.0 2.0
   50    52    54    55   3.62500 -1.0 2.0
   50    52    54    56   3.62500 -1.0 2.0
   51    50    52    53   3.62500 -1.0 2.0
   51    50    52    54   3.62500 -1.0 2.0
   52    54   -56    45   3.62500 -1.0 2.0
   52    54    56    57   3.62500 -1.0 2.0
   53    52    54    55   3.62500 -1.0 2.0
   53    52    54    56   3.62500 -1.0 2.0
   55    54    56    45   3.62500 -1.0 2.0
   55    54    56    57   3.62500 -1.0 2.0
   56    45    48    49   3.62500 -1.0 2.0
   56    45   -48    50   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   37    46    33    29   4.00000 -1.0 2.0
   39    38    37    33   1.10000 -1.0 2.0
   40    42    39    37   4.00000 -1.0 2.0
   43    41    40    39   4.00000 -1.0 2.0
   46    44    43    40   1.10000 -1.0 2.0
   43    47    46    33   4.00000 -1.0 2.0
   48    56    45    42   4.00000 -1.0 2.0
   50    49    48    45   1.10000 -1.0 2.0
   52    51    50    48   1.10000 -1.0 2.0
   54    53    52    50   4.00000 -1.0 2.0
   56    55    54    52   1.10000 -1.0 2.0
   54    57    56    45   4.00000 -1.0 2.0
END
