* LIGAND DATABASE FILE (OPLS2005)
*
001      58    60    115    191     341
    1     0 S   NP   _N1_     1    28.79032    94.23673   -21.03699
    2     1 S   H    _HN1     2     1.02770    88.71969   -77.42581
    3     1 S   H    _H1_     3     1.02964    93.62307    30.89077
    4     1 S   H    _H2_     4     1.02831    29.07439   150.17214
    5     1 S   CT   _CA1     5     1.50144   139.59415   158.60551
    6     5 S   HC   _HA1     6     1.09572   105.22241    54.73815
    7     5 S   CO3  _C1_     7     1.53846   112.39144   -65.41110
    8     7 S   O2Z  _O11     8     1.26357   114.99288   -41.11524
    9     7 S   O2Z  _O12     9     1.26241   114.94382   137.93598
   10     5 S   CT   _CB1    10     1.53090   107.39041   172.67402
   11    10 S   HC   HB11    11     1.09816   109.40749   -49.94793
   12    10 S   HC   HB12    12     1.09822   110.34382    66.62158
   13    10 S   CT   _CG1    13     1.52985   112.68345  -171.09109
   14    13 S   HC   HG11    14     1.09478   110.17666   -61.41264
   15    13 S   HC   HG12    15     1.09628   110.16808    57.65938
   16    13 S   C    _CD1    16     1.51811   112.25907   177.87505
   17    16 S   O    _OE1    17     1.22738   123.12821   -11.34691
   18    16 S   N    _N2_    18     1.38624   111.76893   169.41071
   19    18 S   H    _HN2    19     1.01595   119.02622     0.46646
   20    18 S   CT1  _CA2    20     1.46223   123.40798  -178.05318
   21    20 S   HC   _HA2    21     1.09733   109.27754   -12.82555
   22    20 S   C    _C2_    22     1.53384   108.30748  -128.54371
   23    22 S   O    _O2_    23     1.23014   122.27524  -145.57810
   24    20 S   CT   _CB2    32     1.53504   111.65676   109.14898
   25    24 S   HC   HB21    33     1.09477   110.07761    58.25494
   26    24 S   HC   HB22    34     1.09537   110.16592   176.83801
   27    22 S   N    _N3_    24     1.38524   113.35634    41.73556
   28    27 S   H    _HN3    25     1.01527   118.88780    -0.56993
   29    24 S   S    _SG2    35     1.82618   111.69838   -63.60757
   30    27 S   CT   _CA3    26     1.45441   123.42798   175.20188
   31    30 S   HC   HA31    27     1.09525   109.20112    25.05758
   32    30 S   HC   HA32    28     1.09495   107.12932   142.04682
   33    29 S   CT   _C8_    36     1.83410    99.84203   170.44095
   34    33 S   HC   _H3_    37     1.10200   104.47238    36.31936
   35    30 S   CO3  _C3_    29     1.52924   113.14431   -98.40128
   36    35 S   O2Z  _O31    30     1.26401   115.41861   -44.49156
   37    35 S   O2Z  _O32    31     1.26359   114.97983   136.45863
   38    33 S   CT   _C6_    38     1.54557   115.38527   -78.51628
   39    38 S   HC   _H21    39     1.10004   105.83097    93.43118
   40    38 S   CT   _C7_    40     1.56507   105.85459  -151.74571
   41    40 S   HC   _H22    41     1.09839   108.01500  -112.98090
   42    40 S   CT   _C9_    42     1.54283   108.26031     5.77693
   43    42 S   Cl   CL15    43     1.81825   106.82515  -112.75805
   44    42 S   HC   _H24    44     1.09490   111.65884   134.19373
   45    40 S   CT   _C11    48     1.56525   102.96697   133.00007
   46    45 S   Cl   CL17    49     1.75370   113.48813   162.02329
   47    33 S   CT   _C12    45     1.56323   116.56477   153.83983
   48    47 S   OM   _O33    46     1.31772   110.55622   -79.79310
   49    47 S   Cl   CL18    47     1.79548   114.27008    37.44644
   50    45 S   CM   _C5_    50     1.51300   109.92917   -65.37566
   51    50 S   Cl   CL14    51     1.69520   124.37059  -114.76663
   52    50 S   CM   _C4_    52     1.33997   107.57482    69.14101
   53    52 S   Cl   CL13    53     1.69533   127.92217   175.35691
   54    38 S   CT   _C10    54     1.57416   126.11338   -33.05075
   55    54 S   Cl   CL16    55     1.75465   115.14510    80.45113
   56    45 S   CT   _C13    56     1.56352   101.42904    37.90443
   57    56 S   Cl   CL19    57     1.79728   115.16482    60.55507
   58    56 S   Cl   CL20    58     1.80933   114.52180  -176.66305
  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  10   5   4   3
  16   8   2   1   1  19   9  17   9  10   5   4  11   7   3   1
   1   8   4   6   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    42    47    48    49    54  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    47    48    49    45    52    54    55    56  
   38    39    40    42    47    48    49    54  
   36    37  
   37  
    0  
   39    40    41    42    43    44    47    48    49    45    46    50    52    53    54    55    56    57    58  
   40    41    42    47    45    52    54    55    56  
   41    42    43    44    47    48    49    45    46    50    51    52    54    55    56    57    58  
   42    43    44    47    45    46    50    54    56  
   43    44    47    48    49    45    46    50    54    56  
   44    47    48    49    45  
   47    48    49    45  
   46    50    51    52    53    54    55    56    57    58    47  
   50    51    52    54    56    57    58  
   48    49    54  
   49  
    0  
   51    52    53    54    55    56    57    58  
   52    53    54    56  
   53    54    55    56    57    58  
   54    55    56  
   55    56    57    58  
   56    57    58  
   57    58  
   58  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   43   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   44   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   47   4.2000   0.3000   0.180000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   49   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   50   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   52   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   53   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   54   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   56   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   57   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   58   3.4000   0.3000  -0.135800   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    38   268.000  1.529
   33    47   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    54   268.000  1.529
   40    41   340.000  1.090
   40    42   268.000  1.529
   40    45   268.000  1.529
   42    43   245.000  1.781
   42    44   340.000  1.090
   42    47   268.000  1.529
   47    48   570.000  1.307
   47    49   245.000  1.781
   45    46   245.000  1.781
   45    50   317.000  1.510
   45    56   268.000  1.529
   50    51   300.000  1.725
   50    52   549.000  1.340
   52    53   300.000  1.725
   52    54   317.000  1.510
   54    55   245.000  1.781
   54    56   268.000  1.529
   56    57   245.000  1.781
   56    58   245.000  1.781
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    38    75.00000  111.63000
   29    33    47    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    54    58.35000  112.70000
   33    47    42    58.35000  112.70000
   33    47    48    50.00000  109.50000
   33    47    49    69.00000  109.80000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    42    58.35000  112.70000
   38    40    45    58.35000  112.70000
   38    54    52    70.00000  112.02700
   38    54    55    69.00000  109.80000
   38    54    56    58.35000  112.70000
   40    38    39    37.50000  110.70000
   40    42    43    69.00000  109.80000
   40    42    44    37.50000  110.70000
   40    42    47    58.35000  112.70000
   40    45    46    69.00000  109.80000
   40    45    50    70.00000  112.02700
   40    45    56    58.35000  112.70000
   42    40    41    37.50000  110.70000
   42    47    48    50.00000  109.50000
   42    47    49    69.00000  109.80000
   44    42    43    51.00000  107.60000
   47    33    34    37.50000  110.70000
   47    33    38    58.35000  112.70000
   47    42    43    69.00000  109.80000
   47    42    44    37.50000  110.70000
   49    47    48    95.00000  108.90000
   45    40    41    37.50000  110.70000
   45    40    42    58.35000  112.70000
   45    50    51    75.00000  111.02000
   45    50    52    70.00000  124.00000
   45    56    54    58.35000  112.70000
   45    56    57    69.00000  109.80000
   45    56    58    69.00000  109.80000
   50    45    46    75.00000  111.90500
   50    52    53    75.00000  121.50000
   50    52    54    70.00000  124.00000
   52    50    51    75.00000  121.50000
   52    54    55    75.00000  111.90500
   52    54    56    70.00000  112.02700
   54    38    39    37.50000  110.70000
   54    38    40    58.35000  112.70000
   54    52    53    75.00000  111.02000
   54    56    57    69.00000  109.80000
   54    56    58    69.00000  109.80000
   56    45    46    69.00000  109.80000
   56    45    50    70.00000  112.02700
   56    54    55    69.00000  109.80000
   58    56    57    80.00000  110.42200
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   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    38    39   0.15000  1.0 3.0
   29    33    38    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    54   0.44750  1.0 1.0
   29    33    38    54  -0.17800 -1.0 2.0
   29    33    38    54   0.20200  1.0 3.0
   29    33    47    42   0.44750  1.0 1.0
   29    33    47    42  -0.17800 -1.0 2.0
   29    33    47    42   0.20200  1.0 3.0
   29    33    47    48   0.56750  1.0 1.0
   29    33    47    48  -0.07550 -1.0 2.0
   29    33    47    48   0.20000  1.0 3.0
   29    33    47    49   0.56750  1.0 1.0
   29    33    47    49  -0.07550 -1.0 2.0
   29    33    47    49   0.20000  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38   -40    42   0.56750  1.0 1.0
   33    38   -40    42  -0.07550 -1.0 2.0
   33    38   -40    42   0.20000  1.0 3.0
   33    38    40    45   0.56750  1.0 1.0
   33    38    40    45  -0.07550 -1.0 2.0
   33    38    40    45   0.20000  1.0 3.0
   33    38    54    52   0.34400  1.0 1.0
   33    38    54    52   0.09450 -1.0 2.0
   33    38    54    52   0.11100  1.0 3.0
   33    38    54    55   0.35600  1.0 1.0
   33    38    54    55  -0.14650 -1.0 2.0
   33    38    54    55   0.33350  1.0 3.0
   33    38    54    56   0.56750  1.0 1.0
   33    38    54    56  -0.07550 -1.0 2.0
   33    38    54    56   0.20000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    54   0.15000  1.0 3.0
   34    33    47    42   0.15000  1.0 3.0
   34    33    47    48   0.23400  1.0 3.0
   34    33    47    49   0.27000  1.0 3.0
   38    33   -47    42   0.56750  1.0 1.0
   38    33   -47    42  -0.07550 -1.0 2.0
   38    33   -47    42   0.20000  1.0 3.0
   38    33    47    48   0.62750  1.0 1.0
   38    33    47    48  -0.30950 -1.0 2.0
   38    33    47    48   0.27300  1.0 3.0
   38    33    47    49   0.35600  1.0 1.0
   38    33    47    49  -0.14650 -1.0 2.0
   38    33    47    49   0.33350  1.0 3.0
   38    40    42    43   0.35600  1.0 1.0
   38    40    42    43  -0.14650 -1.0 2.0
   38    40    42    43   0.33350  1.0 3.0
   38    40    42    44   0.15000  1.0 3.0
   38    40   -42    47   0.56750  1.0 1.0
   38    40   -42    47  -0.07550 -1.0 2.0
   38    40   -42    47   0.20000  1.0 3.0
   38    40    45    46   0.35600  1.0 1.0
   38    40    45    46  -0.14650 -1.0 2.0
   38    40    45    46   0.33350  1.0 3.0
   38    40    45    50   0.34400  1.0 1.0
   38    40    45    50   0.09450 -1.0 2.0
   38    40    45    50   0.11100  1.0 3.0
   38    40   -45    56   0.56750  1.0 1.0
   38    40   -45    56  -0.07550 -1.0 2.0
   38    40   -45    56   0.20000  1.0 3.0
   38    54   -56    45   0.56750  1.0 1.0
   38    54   -56    45  -0.07550 -1.0 2.0
   38    54   -56    45   0.20000  1.0 3.0
   38    54    56    57   0.35600  1.0 1.0
   38    54    56    57  -0.14650 -1.0 2.0
   38    54    56    57   0.33350  1.0 3.0
   38    54    56    58   0.35600  1.0 1.0
   38    54    56    58  -0.14650 -1.0 2.0
   38    54    56    58   0.33350  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    42   0.15000  1.0 3.0
   39    38    40    45   0.15000  1.0 3.0
   39    38    54    52   0.15000  1.0 3.0
   39    38    54    55   0.27000  1.0 3.0
   39    38    54    56   0.15000  1.0 3.0
   40    38    54    52   0.34400  1.0 1.0
   40    38    54    52   0.09450 -1.0 2.0
   40    38    54    52   0.11100  1.0 3.0
   40    38    54    55   0.35600  1.0 1.0
   40    38    54    55  -0.14650 -1.0 2.0
   40    38    54    55   0.33350  1.0 3.0
   40    38   -54    56   0.56750  1.0 1.0
   40    38   -54    56  -0.07550 -1.0 2.0
   40    38   -54    56   0.20000  1.0 3.0
   40    42   -47    33   0.56750  1.0 1.0
   40    42   -47    33  -0.07550 -1.0 2.0
   40    42   -47    33   0.20000  1.0 3.0
   40    42    47    48   0.62750  1.0 1.0
   40    42    47    48  -0.30950 -1.0 2.0
   40    42    47    48   0.27300  1.0 3.0
   40    42    47    49   0.35600  1.0 1.0
   40    42    47    49  -0.14650 -1.0 2.0
   40    42    47    49   0.33350  1.0 3.0
   40    45    50    51   0.09700  1.0 1.0
   40    45    50    51   0.15600 -1.0 2.0
   40    45    50    51  -0.50800  1.0 3.0
   40    45   -50    52   0.09850  1.0 1.0
   40    45   -50    52   0.15250 -1.0 2.0
   40    45   -50    52  -0.50650  1.0 3.0
   40    45   -56    54   0.56750  1.0 1.0
   40    45   -56    54  -0.07550 -1.0 2.0
   40    45   -56    54   0.20000  1.0 3.0
   40    45    56    57   0.35600  1.0 1.0
   40    45    56    57  -0.14650 -1.0 2.0
   40    45    56    57   0.33350  1.0 3.0
   40    45    56    58   0.35600  1.0 1.0
   40    45    56    58  -0.14650 -1.0 2.0
   40    45    56    58   0.33350  1.0 3.0
   41    40    42    43   0.27000  1.0 3.0
   41    40    42    44   0.15000  1.0 3.0
   41    40    42    47   0.15000  1.0 3.0
   41    40    45    46   0.27000  1.0 3.0
   41    40    45    50   0.15000  1.0 3.0
   41    40    45    56   0.15000  1.0 3.0
   42    40    45    46   0.35600  1.0 1.0
   42    40    45    46  -0.14650 -1.0 2.0
   42    40    45    46   0.33350  1.0 3.0
   42    40    45    50   0.34400  1.0 1.0
   42    40    45    50   0.09450 -1.0 2.0
   42    40    45    50   0.11100  1.0 3.0
   42    40    45    56   0.56750  1.0 1.0
   42    40    45    56  -0.07550 -1.0 2.0
   42    40    45    56   0.20000  1.0 3.0
   43    42    47    33   0.35600  1.0 1.0
   43    42    47    33  -0.14650 -1.0 2.0
   43    42    47    33   0.33350  1.0 3.0
   43    42    47    48   0.56750  1.0 1.0
   43    42    47    48  -0.07550 -1.0 2.0
   43    42    47    48   0.20000  1.0 3.0
   43    42    47    49   0.22500  1.0 1.0
   44    42    47    33   0.15000  1.0 3.0
   44    42    47    48   0.23400  1.0 3.0
   44    42    47    49   0.27000  1.0 3.0
   47    33    38    39   0.15000  1.0 3.0
   47    33   -38    40   0.56750  1.0 1.0
   47    33   -38    40  -0.07550 -1.0 2.0
   47    33   -38    40   0.20000  1.0 3.0
   47    33    38    54   0.56750  1.0 1.0
   47    33    38    54  -0.07550 -1.0 2.0
   47    33    38    54   0.20000  1.0 3.0
   45    40    42    43   0.35600  1.0 1.0
   45    40    42    43  -0.14650 -1.0 2.0
   45    40    42    43   0.33350  1.0 3.0
   45    40    42    44   0.15000  1.0 3.0
   45    40    42    47   0.56750  1.0 1.0
   45    40    42    47  -0.07550 -1.0 2.0
   45    40    42    47   0.20000  1.0 3.0
   45    50    52    53   7.00000 -1.0 2.0
   45    50   -52    54   7.00000 -1.0 2.0
   46    45    50    51   0.09700  1.0 1.0
   46    45    50    51   0.15600 -1.0 2.0
   46    45    50    51  -0.50800  1.0 3.0
   46    45    50    52   0.09700  1.0 1.0
   46    45    50    52   0.15600 -1.0 2.0
   46    45    50    52  -0.50800  1.0 3.0
   46    45    56    54   0.35600  1.0 1.0
   46    45    56    54  -0.14650 -1.0 2.0
   46    45    56    54   0.33350  1.0 3.0
   46    45    56    57   0.22500  1.0 1.0
   46    45    56    58   0.22500  1.0 1.0
   50    45   -56    54   0.34400  1.0 1.0
   50    45   -56    54   0.09450 -1.0 2.0
   50    45   -56    54   0.11100  1.0 3.0
   50    45    56    57   0.56750  1.0 1.0
   50    45    56    57  -0.07550 -1.0 2.0
   50    45    56    57   0.20000  1.0 3.0
   50    45    56    58   0.56750  1.0 1.0
   50    45    56    58  -0.07550 -1.0 2.0
   50    45    56    58   0.20000  1.0 3.0
   50    52   -54    38   0.09850  1.0 1.0
   50    52   -54    38   0.15250 -1.0 2.0
   50    52   -54    38  -0.50650  1.0 3.0
   50    52    54    55   0.09700  1.0 1.0
   50    52    54    55   0.15600 -1.0 2.0
   50    52    54    55  -0.50800  1.0 3.0
   50    52   -54    56   0.09850  1.0 1.0
   50    52   -54    56   0.15250 -1.0 2.0
   50    52   -54    56  -0.50650  1.0 3.0
   51    50    52    53   7.00000 -1.0 2.0
   51    50    52    54   7.00000 -1.0 2.0
   52    54   -56    45   0.34400  1.0 1.0
   52    54   -56    45   0.09450 -1.0 2.0
   52    54   -56    45   0.11100  1.0 3.0
   52    54    56    57   0.56750  1.0 1.0
   52    54    56    57  -0.07550 -1.0 2.0
   52    54    56    57   0.20000  1.0 3.0
   52    54    56    58   0.56750  1.0 1.0
   52    54    56    58  -0.07550 -1.0 2.0
   52    54    56    58   0.20000  1.0 3.0
   53    52    54    38   0.09700  1.0 1.0
   53    52    54    38   0.15600 -1.0 2.0
   53    52    54    38  -0.50800  1.0 3.0
   53    52    54    55   0.09700  1.0 1.0
   53    52    54    55   0.15600 -1.0 2.0
   53    52    54    55  -0.50800  1.0 3.0
   53    52    54    56   0.09700  1.0 1.0
   53    52    54    56   0.15600 -1.0 2.0
   53    52    54    56  -0.50800  1.0 3.0
   54    38    40    41   0.15000  1.0 3.0
   54    38    40    42   0.56750  1.0 1.0
   54    38    40    42  -0.07550 -1.0 2.0
   54    38    40    42   0.20000  1.0 3.0
   54    38   -40    45   0.56750  1.0 1.0
   54    38   -40    45  -0.07550 -1.0 2.0
   54    38   -40    45   0.20000  1.0 3.0
   55    54    56    45   0.35600  1.0 1.0
   55    54    56    45  -0.14650 -1.0 2.0
   55    54    56    45   0.33350  1.0 3.0
   55    54    56    57   0.22500  1.0 1.0
   55    54    56    58   0.22500  1.0 1.0
   56    45    50    51   0.09700  1.0 1.0
   56    45    50    51   0.15600 -1.0 2.0
   56    45    50    51  -0.50800  1.0 3.0
   56    45   -50    52   0.09850  1.0 1.0
   56    45   -50    52   0.15250 -1.0 2.0
   56    45   -50    52  -0.50650  1.0 3.0
IPHI
    9     5     7     8  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    35    36  10.50000 -1.0 2.0
   45    51    50    52   1.10000 -1.0 2.0
   54    53    52    50   1.10000 -1.0 2.0
END
