* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    113    166     329
    1     0 S   NP   _N1_     1    28.80094    94.52971   -20.85978
    2     1 S   H    _HN1     2     1.02961    91.39633    21.44978
    3     1 S   H    _H1_     3     1.02836    32.01693   142.35105
    4     1 S   H    _H2_     4     1.02778    87.37287   -86.83639
    5     1 S   CT   _CA1     5     1.50107   142.64085   148.78730
    6     5 S   HC   _HA1     6     1.09569   105.26921    55.52843
    7     5 S   CO3  _C1_     7     1.53863   112.39053   -64.77176
    8     7 S   O2Z  _O11     8     1.26365   115.00298   -43.11968
    9     7 S   O2Z  _O12     9     1.26242   114.96281   136.13708
   10     5 S   CT   _CB1    10     1.53115   107.43667   173.54469
   11    10 S   HC   HB11    11     1.09817   109.55834   -49.96266
   12    10 S   HC   HB12    12     1.09823   110.30941    66.67494
   13    10 S   CT   _CG1    13     1.52960   112.55640  -171.04783
   14    13 S   HC   HG11    14     1.09491   110.22553   -60.52191
   15    13 S   HC   HG12    15     1.09629   110.12054    58.66044
   16    13 S   C    _CD1    16     1.51746   112.42474   179.30142
   17    16 S   O    _OE1    17     1.22712   123.25477    -5.93564
   18    16 S   N    _N2_    18     1.38636   111.57469   174.09435
   19    18 S   H    _HN2    19     1.01584   119.04788     2.17457
   20    18 S   CT1  _CA2    20     1.46236   123.41033  -177.31052
   21    20 S   HC   _HA2    21     1.09727   109.37081   -10.34106
   22    20 S   C    _C2_    22     1.53404   108.58270  -126.16350
   23    22 S   O    _O2_    23     1.23020   122.17109  -147.03889
   24    20 S   CT   _CB2    32     1.53464   111.22993   111.56613
   25    24 S   HC   HB21    33     1.09464   109.59713    56.96363
   26    24 S   HC   HB22    34     1.09512   110.55356   175.69689
   27    22 S   N    _N3_    24     1.38488   113.42923    40.38244
   28    27 S   H    _HN3    25     1.01524   118.88920    -0.74834
   29    24 S   S    _SG2    35     1.82778   111.52764   -64.61868
   30    27 S   CT   _CA3    26     1.45458   123.55942   175.14151
   31    30 S   HC   HA31    27     1.09514   109.36913    21.66003
   32    30 S   HC   HA32    28     1.09499   107.08615   138.68675
   33    29 S   CT   _C9_    36     1.84249    99.80758   167.35439
   34    33 S   HC   _H3_    37     1.09613   106.94218    43.10967
   35    30 S   CO3  _C3_    29     1.52918   113.03679  -101.90975
   36    35 S   O2Z  _O31    30     1.26408   115.37705   -44.81511
   37    35 S   O2Z  _O32    31     1.26350   115.00000   136.10144
   38    33 S   CO4  _C5_    38     1.52063   107.90042   -74.73636
   39    38 S   O    _O33    39     1.22962   121.67534   107.53863
   40    38 S   CM   _C4_    40     1.50407   116.97828   -73.67229
   41    40 S   CT   _C7_    41     1.50868   113.41274   -47.80111
   42    41 S   HC   _H14    42     1.09378   112.03562   166.73782
   43    41 S   HC   _H15    43     1.09663   108.58234   -76.06913
   44    40 S   CM   _C6_    54     1.35243   120.06200   132.54642
   45    41 S   CT   _C8_    44     1.53134   112.84072    45.86043
   46    45 S   HC   _H16    45     1.09811   109.50543    72.70407
   47    45 S   HC   _H17    46     1.09800   109.30881  -173.21291
   48    44 S   CT   _C11    55     1.50935   123.32017   175.96333
   49    48 S   HC   _H19    56     1.09446   110.09004   104.98385
   50    48 S   HC   _H20    57     1.09596   110.07288  -135.74364
   51    48 S   HC   _H21    58     1.09211   113.61958   -16.93910
   52    44 S   CT   _C12    59     1.51025   124.51234    -4.21213
   53    52 S   HC   _H22    60     1.09466   110.07278   102.82298
   54    52 S   HC   _H23    61     1.09538   110.20491  -138.06795
   55    52 S   HC   _H24    62     1.09208   113.55788   -19.19531
   56    33 S   CT   _C10    47     1.54628   113.35410   163.51161
   57    56 S   CT   _C13    48     1.53854   110.20981  -167.44180
   58    57 S   HC   _H25    49     1.09637   110.55245    61.57666
   59    57 S   HC   _H26    50     1.09377   112.80721   -59.60916
   60    57 S   HC   _H27    51     1.09622   110.73753   178.97798
   61    56 S   OH   _O34    52     1.43325   109.13162   -51.39506
   62    61 S   HO   _H28    53     0.97256   108.11408   177.56876
  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   9   5   4   3
  16   7   2   1   1  12   4  16  11   6   5   9   9   4   3   7
   3   2   1   3   2   1   1   6   5   3   2   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    56    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    56    57    61  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    46    47    56    57    58    59    60    61    62    44  
   38    39    40    45    56    57    61  
   36    37  
   37  
    0  
   39    40    41    42    43    45    56    57    61    44    48    52  
   40    41    56    44  
   41    42    43    45    46    47    56    44    48    49    50    51    52    53    54    55  
   42    43    45    46    47    56    57    61    44    48    52  
   43    45    46    47    56    44  
   45    46    47    56    44  
   48    49    50    51    52    53    54    55    45  
   46    47    56    57    58    59    60    61    62  
   47    56    57    61  
   56    57    61  
   49    50    51    52    53    54    55  
   50    51    52  
   51    52  
   52  
   53    54    55  
   54    55  
   55  
    0  
   57    58    59    60    61    62  
   58    59    60    61    62  
   59    60    61  
   60    61  
   61  
   62  
    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   2.4200   0.0150   0.060000   1.3810   1.2100   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   57   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   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    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   317.000  1.522
   33    56   268.000  1.529
   38    39   570.000  1.229
   38    40   320.000  1.462
   40    41   317.000  1.510
   40    44   549.000  1.340
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    56   268.000  1.529
   56    57   268.000  1.529
   56    61   320.000  1.410
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   61    62   553.000  0.945
   44    48   317.000  1.510
   44    52   317.000  1.510
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   340.000  1.090
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   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    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  110.18000
   29    33    56    75.00000  111.63000
   33    38    39    80.00000  120.40000
   33    38    40    65.00000  118.62400
   33    56    45    58.35000  112.70000
   33    56    57    58.35000  112.70000
   33    56    61    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  116.34900
   38    40    44    65.00000  118.96000
   40    38    39    80.00000  123.72100
   40    41    42    35.00000  109.50000
   40    41    43    35.00000  109.50000
   40    41    45    70.00000  112.02700
   40    44    48    70.00000  124.00000
   40    44    52    70.00000  124.00000
   41    45    46    37.50000  110.70000
   41    45    47    37.50000  110.70000
   41    45    56    58.35000  112.70000
   43    41    42    33.00000  107.80000
   45    41    42    37.50000  110.70000
   45    41    43    37.50000  110.70000
   45    56    57    58.35000  112.70000
   45    56    61    50.00000  109.50000
   47    45    46    33.00000  107.80000
   56    33    34    37.50000  110.70000
   56    33    38    63.00000  111.10000
   56    45    46    37.50000  110.70000
   56    45    47    37.50000  110.70000
   56    57    58    37.50000  110.70000
   56    57    59    37.50000  110.70000
   56    57    60    37.50000  110.70000
   56    61    62    55.00000  108.50000
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   61    56    57    50.00000  109.50000
   44    40    41    70.00000  124.00000
   44    48    49    35.00000  109.50000
   44    48    50    35.00000  109.50000
   44    48    51    35.00000  109.50000
   44    52    53    35.00000  109.50000
   44    52    54    35.00000  109.50000
   44    52    55    35.00000  109.50000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    33.00000  107.80000
   52    44    48    65.00000  117.92700
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    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    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    56   0.01700  1.0 1.0
   24    29    33    56  -0.23550 -1.0 2.0
   24    29    33    56   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   0.30150 -1.0 2.0
   29    33    38    40   0.65300  1.0 1.0
   29    33    38    40  -0.03850 -1.0 2.0
   29    33    38    40   0.33900  1.0 3.0
   29    33    56    45   0.44750  1.0 1.0
   29    33    56    45  -0.17800 -1.0 2.0
   29    33    56    45   0.20200  1.0 3.0
   29    33    56    57   0.44750  1.0 1.0
   29    33    56    57  -0.17800 -1.0 2.0
   29    33    56    57   0.20200  1.0 3.0
   29    33    56    61   0.56750  1.0 1.0
   29    33    56    61  -0.07550 -1.0 2.0
   29    33    56    61   0.20000  1.0 3.0
   33    38    40    41   0.25700  1.0 1.0
   33    38    40    41   0.66200 -1.0 2.0
   33    38    40    41   0.04450  1.0 3.0
   33    38    40    44  -0.33500  1.0 1.0
   33    38    40    44   1.06600 -1.0 2.0
   33    38    40    44  -0.14000  1.0 3.0
   33    56    57    58   0.15000  1.0 3.0
   33    56    57    59   0.15000  1.0 3.0
   33    56    57    60   0.15000  1.0 3.0
   33    56    61    62  -0.11600  1.0 1.0
   33    56    61    62  -0.09450 -1.0 2.0
   33    56    61    62   0.21250  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    56    45   0.15000  1.0 3.0
   34    33    56    57   0.15000  1.0 3.0
   34    33    56    61   0.23400  1.0 3.0
   38    33    56    45  -0.95700  1.0 1.0
   38    33    56    45  -0.18200 -1.0 2.0
   38    33    56    45   0.29450  1.0 3.0
   38    33    56    57  -0.95700  1.0 1.0
   38    33    56    57  -0.18200 -1.0 2.0
   38    33    56    57   0.29450  1.0 3.0
   38    33    56    61  -0.09450  1.0 1.0
   38    33    56    61  -1.12950 -1.0 2.0
   38    33    56    61   0.54000  1.0 3.0
   38    40    41    42   0.15000  1.0 3.0
   38    40    41    43   0.15000  1.0 3.0
   38    40   -41    45   0.09700  1.0 1.0
   38    40   -41    45   0.15600 -1.0 2.0
   38    40   -41    45  -0.50800  1.0 3.0
   38    40    44    48   7.00000 -1.0 2.0
   38    40    44    52   7.00000 -1.0 2.0
   39    38    40    41  -0.64400  1.0 1.0
   39    38    40    41   0.26850 -1.0 2.0
   39    38    40    44   1.00000 -1.0 2.0
   40    41    45    46   0.15000  1.0 3.0
   40    41    45    47   0.15000  1.0 3.0
   40    41    45    56   0.34400  1.0 1.0
   40    41    45    56   0.09450 -1.0 2.0
   40    41    45    56   0.11100  1.0 3.0
   40    44    48    49   0.00000  1.0 1.0
   40    44    48    50   0.00000  1.0 1.0
   40    44    48    51   0.00000  1.0 1.0
   40    44    52    53   0.00000  1.0 1.0
   40    44    52    54   0.00000  1.0 1.0
   40    44    52    55   0.00000  1.0 1.0
   41    40    44    48   7.00000 -1.0 2.0
   41    40    44    52   7.00000 -1.0 2.0
   41    45   -56    33   0.56750  1.0 1.0
   41    45   -56    33  -0.07550 -1.0 2.0
   41    45   -56    33   0.20000  1.0 3.0
   41    45    56    57   0.56750  1.0 1.0
   41    45    56    57  -0.07550 -1.0 2.0
   41    45    56    57   0.20000  1.0 3.0
   41    45    56    61   0.86500  1.0 1.0
   41    45    56    61  -0.17500 -1.0 2.0
   41    45    56    61   0.20800  1.0 3.0
   42    41    45    46   0.15000  1.0 3.0
   42    41    45    47   0.15000  1.0 3.0
   42    41    45    56   0.15000  1.0 3.0
   43    41    45    46   0.15000  1.0 3.0
   43    41    45    47   0.15000  1.0 3.0
   43    41    45    56   0.15000  1.0 3.0
   45    56    57    58   0.15000  1.0 3.0
   45    56    57    59   0.15000  1.0 3.0
   45    56    57    60   0.15000  1.0 3.0
   45    56    61    62  -0.11600  1.0 1.0
   45    56    61    62  -0.09450 -1.0 2.0
   45    56    61    62   0.21250  1.0 3.0
   46    45    56    33   0.15000  1.0 3.0
   46    45    56    57   0.15000  1.0 3.0
   46    45    56    61   0.23400  1.0 3.0
   47    45    56    33   0.15000  1.0 3.0
   47    45    56    57   0.15000  1.0 3.0
   47    45    56    61   0.23400  1.0 3.0
   56    33    38    39   0.30150 -1.0 2.0
   56    33   -38    40   0.65300  1.0 1.0
   56    33   -38    40  -0.03850 -1.0 2.0
   56    33   -38    40   0.33900  1.0 3.0
   57    56    61    62  -0.11600  1.0 1.0
   57    56    61    62  -0.09450 -1.0 2.0
   57    56    61    62   0.21250  1.0 3.0
   61    56    57    58   0.23400  1.0 3.0
   61    56    57    59   0.23400  1.0 3.0
   61    56    57    60   0.23400  1.0 3.0
   44    40    41    42   0.00000  1.0 1.0
   44    40    41    43   0.00000  1.0 1.0
   44    40    41    45   0.09850  1.0 1.0
   44    40    41    45   0.15250 -1.0 2.0
   44    40    41    45  -0.50650  1.0 3.0
   48    44    52    53   0.34800  1.0 3.0
   48    44    52    54   0.34800  1.0 3.0
   48    44    52    55   0.34800  1.0 3.0
   52    44    48    49   0.34800  1.0 3.0
   52    44    48    50   0.34800  1.0 3.0
   52    44    48    51   0.34800  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
   33    40    38    39  10.50000 -1.0 2.0
   38    41    40    44   1.10000 -1.0 2.0
   48    52    44    40   1.10000 -1.0 2.0
END
