* LIGAND DATABASE FILE (OPLS2005)
*
001      64    65    119    177     343
    1     0 S   NP   _N1_     1    28.56932    92.17858   -18.86507
    2     1 S   H    _HN1     2     1.03068   105.08734    13.94422
    3     1 S   H    _H1_     3     1.02830    34.69287   112.28642
    4     1 S   H    _H2_     4     1.02770    76.03423   -91.42542
    5     1 S   CT   _CA1     5     1.50093   137.82074   160.75012
    6     5 S   HC   _HA1     6     1.09573   105.28895    33.22363
    7     5 S   CO3  _C1_     7     1.53808   112.24429   -87.02407
    8     7 S   O2Z  _O11     8     1.26337   115.09461   -49.16310
    9     7 S   O2Z  _O12     9     1.26243   114.86383   130.02090
   10     5 S   CT   _CB1    10     1.53036   107.38609   151.04835
   11    10 S   HC   HB11    11     1.09813   109.45142   -51.32281
   12    10 S   HC   HB12    12     1.09672   110.33607    65.27288
   13    10 S   CT   _CG1    13     1.52911   112.83460  -172.79062
   14    13 S   HC   HG11    14     1.09600   110.35723   -60.57966
   15    13 S   HC   HG12    15     1.09621   110.17031    58.68618
   16    13 S   C    _CD1    16     1.51805   112.02099   178.94873
   17    16 S   O    _OE1    17     1.22743   123.22384   -10.10760
   18    16 S   N    _N2_    18     1.38454   111.70280   170.19234
   19    18 S   H    _HN2    19     1.01570   118.96808     5.24411
   20    18 S   CT1  _CA2    20     1.45821   123.20422   179.12912
   21    20 S   HC   _HA2    21     1.09566   109.12280    18.84730
   22    20 S   C    _C2_    22     1.52871   106.98810   -97.95998
   23    22 S   O    _O2_    23     1.22989   123.00783   -25.81398
   24    20 S   CT   _CB2    32     1.53088   111.85313   142.24194
   25    24 S   HC   HB21    33     1.09666   109.77397    58.13899
   26    24 S   HC   HB22    34     1.09558   111.39611   175.59513
   27    22 S   N    _N3_    24     1.38493   112.63765   156.84880
   28    27 S   H    _HN3    25     1.01674   120.41987    -2.13359
   29    24 S   S    _SG2    35     1.82815   113.54007   -61.15477
   30    27 S   CT   _CA3    26     1.45364   122.35093   178.66206
   31    30 S   HC   HA31    27     1.09571   107.74831   -56.59791
   32    30 S   HC   HA32    28     1.09566   107.64186    59.69383
   33    29 S   CT   _C10    36     1.85643   100.26998   -72.38689
   34    33 S   HC   _H5_    37     1.09884   106.91312   -11.30075
   35    30 S   CO3  _C3_    29     1.52861   114.43364  -178.52847
   36    35 S   O2Z  _O31    30     1.26311   116.08745    -1.32471
   37    35 S   O2Z  _O32    31     1.26446   114.39312   178.67249
   38    33 S   CT   _C11    38     1.57012   109.41965  -129.13301
   39    38 S   OM   _O33    39     1.32474   108.68669   158.30298
   40    38 S   HC   _H6_    40     1.10052   106.99370    30.03007
   41    38 S   CM   _C12    41     1.51371   112.25281   -85.03750
   42    41 S   HC   _H14    42     1.08915   116.99088   166.48861
   43    41 S   CM   _C13    43     1.34203   124.84121   -11.01769
   44    43 S   HC   _H15    44     1.08781   117.87268   176.67763
   45    43 S   CT   _C8_    45     1.50618   123.87885    -1.72850
   46    45 S   HC   _H3_    46     1.09684   106.19002   107.27410
   47    33 S   CT   _C9_    47     1.55111   109.57817   106.45212
   48    47 S   HC   _H4_    48     1.09444   109.53512   -51.69931
   49    45 S   S    _S1_    51     1.84366   108.05718  -138.93739
   50    47 S   OH   _O34    49     1.43421   108.47408  -166.03350
   51    50 S   HO   _H16    50     0.97521   107.09042   -51.03437
   52    49 S   CT   _C7_    52     1.82160    99.98577  -169.05522
   53    52 S   HC   _H12    53     1.09473   109.16299    57.98895
   54    52 S   HC   _H13    54     1.09317   109.27002   -60.50636
   55    52 S   CT   _C6_    55     1.52898   109.55405   178.96846
   56    55 S   HC   _H10    56     1.09859   109.66939   -56.62668
   57    55 S   HC   _H11    57     1.09759   110.22278    60.44811
   58    55 S   C3T  _C5_    58     1.50624   112.06346  -178.63212
   59    58 S   NN   _N4_    59     1.42683   117.20123   142.41607
   60    58 S   CT   _C4_    61     1.49569   118.12718   -68.94927
   61    60 S   HC   _H7_    62     1.09584   111.86204  -173.25445
   62    60 S   HC   _H8_    63     1.09389   110.82612    66.79751
   63    60 S   HC   _H9_    64     1.09472   110.47807   -53.25366
   64    58 S   NN   _N5_    60     1.42439   117.99186    83.52576
  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
  14   8   2   1   1  10   5   4   7   3   8   4  10   5   5   3
   8   1   1   9   5   4   9   5   4   6   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    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    41    45    47    48    50  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    45    46    47    48    50    51    49  
   38    39    40    41    45    47    48    50  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    47    48    50  
   40    41    42    43    47  
   41    42    43    47  
   42    43    44    45    46    47    49  
   43    44    45  
   44    45    46    47    48    50    49    52  
   45    46    47    49  
   46    47    48    50    51    49    52    53    54    55  
   47    48    50    49    52  
   48    50    51    49    52  
   50    51    49  
   52    53    54    55    56    57    58    50  
   51  
    0  
   53    54    55    56    57    58    59    64    60  
   54    55    56    57    58  
   55    56    57    58  
   56    57    58    59    64    60    61    62    63  
   57    58    59    64    60  
   58    59    64    60  
   59    64    60    61    62    63  
   64    60    61    62    63  
   61    62    63    64  
   62    63    64  
   63    64  
   64  
    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   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   39   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   40   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   50   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5000   0.0660   0.047500   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660   0.245000   1.9750   1.7500   0.005000000  -0.741685710
   59   3.2500   0.1700  -0.122500   1.8375   1.6250   0.005000000   0.000000000
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.2500   0.1700  -0.122500   1.8375   1.6250   0.005000000   0.000000000
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   570.000  1.307
   38    40   340.000  1.090
   38    41   317.000  1.510
   41    42   340.000  1.080
   41    43   549.000  1.340
   43    44   340.000  1.080
   43    45   317.000  1.510
   45    46   340.000  1.090
   45    47   268.000  1.529
   45    49   222.000  1.810
   47    48   340.000  1.090
   47    50   320.000  1.410
   50    51   553.000  0.945
   49    52   222.000  1.810
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   275.000  1.510
   58    59   255.000  1.500
   58    64   255.000  1.500
   58    60   275.000  1.510
   59    64   470.000  1.265
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   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  111.63000
   29    33    47    75.00000  111.63000
   33    38    39    50.00000  109.50000
   33    38    40    37.50000  110.70000
   33    38    41    70.00000  112.02700
   33    47    45    58.35000  112.70000
   33    47    48    37.50000  110.70000
   33    47    50    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    42    35.00000  117.00000
   38    41    43    70.00000  124.00000
   40    38    39    45.00000  125.66300
   41    38    39    85.00000  110.90400
   41    38    40    35.00000  109.50000
   41    43    44    35.00000  120.00000
   41    43    45    70.00000  124.00000
   43    41    42    35.00000  120.00000
   43    45    46    35.00000  109.50000
   43    45    47    70.00000  112.02700
   43    45    49    75.00000  112.20000
   45    43    44    35.00000  117.00000
   45    47    48    37.50000  110.70000
   45    47    50    50.00000  109.50000
   45    49    52    62.00000   98.90000
   47    33    34    37.50000  110.70000
   47    33    38    58.35000  112.70000
   47    45    46    37.50000  110.70000
   47    50    51    55.00000  108.50000
   50    47    48    35.00000  109.50000
   49    45    46    35.00000  109.50000
   49    45    47    75.00000  111.63000
   49    52    53    35.00000  109.50000
   49    52    54    35.00000  109.50000
   49    52    55    75.00000  111.63000
   52    55    56    37.50000  110.70000
   52    55    57    37.50000  110.70000
   52    55    58    70.00000  112.37300
   54    52    53    33.00000  107.80000
   55    52    53    37.50000  110.70000
   55    52    54    37.50000  110.70000
   55    58    59    85.00000  105.04000
   55    58    64    85.00000  105.04000
   55    58    60    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    45.00000  109.38400
   58    55    57    45.00000  109.38400
   58    59    64    10.00000   60.00000
   58    64    59    10.00000   60.00000
   58    60    61    45.00000  109.38400
   58    60    62    45.00000  109.38400
   58    60    63    45.00000  109.38400
   64    58    59    10.00000   60.00000
   60    58    59    85.00000  105.04000
   60    58    64    85.00000  105.04000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    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    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   0.56750  1.0 1.0
   29    33    38    39  -0.07550 -1.0 2.0
   29    33    38    39   0.20000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    47    45   0.44750  1.0 1.0
   29    33    47    45  -0.17800 -1.0 2.0
   29    33    47    45   0.20200  1.0 3.0
   29    33    47    48   0.15000  1.0 3.0
   29    33    47    50   0.56750  1.0 1.0
   29    33    47    50  -0.07550 -1.0 2.0
   29    33    47    50   0.20000  1.0 3.0
   33    38    41    42   0.00000  1.0 1.0
   33    38    41    43   0.09850  1.0 1.0
   33    38    41    43   0.15250 -1.0 2.0
   33    38    41    43  -0.50650  1.0 3.0
   33    47    50    51  -0.11600  1.0 1.0
   33    47    50    51  -0.09450 -1.0 2.0
   33    47    50    51   0.21250  1.0 3.0
   34    33    38    39   0.23400  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    47    45   0.15000  1.0 3.0
   34    33    47    48   0.15000  1.0 3.0
   34    33    47    50   0.23400  1.0 3.0
   38    33    47    45   0.56750  1.0 1.0
   38    33    47    45  -0.07550 -1.0 2.0
   38    33    47    45   0.20000  1.0 3.0
   38    33    47    48   0.15000  1.0 3.0
   38    33    47    50   0.86500  1.0 1.0
   38    33    47    50  -0.17500 -1.0 2.0
   38    33    47    50   0.20800  1.0 3.0
   38    41    43    44   7.00000 -1.0 2.0
   38    41   -43    45   7.00000 -1.0 2.0
   39    38    41    42   0.00000  1.0 1.0
   39    38    41    43   0.39000  1.0 1.0
   39    38    41    43  -0.05800 -1.0 2.0
   39    38    41    43  -0.55150  1.0 3.0
   40    38    41    42   0.33100  1.0 3.0
   40    38    41    43   0.00000  1.0 1.0
   41    43    45    46   0.00000  1.0 1.0
   41    43    45    47   0.09850  1.0 1.0
   41    43    45    47   0.15250 -1.0 2.0
   41    43    45    47  -0.50650  1.0 3.0
   41    43    45    49   0.42700  1.0 1.0
   41    43    45    49  -0.70350 -1.0 2.0
   41    43    45    49  -0.43150  1.0 3.0
   42    41    43    44   7.00000 -1.0 2.0
   42    41    43    45   7.00000 -1.0 2.0
   43    45   -47    33   0.34400  1.0 1.0
   43    45   -47    33   0.09450 -1.0 2.0
   43    45   -47    33   0.11100  1.0 3.0
   43    45    47    48   0.15000  1.0 3.0
   43    45    47    50   1.05650  1.0 1.0
   43    45    47    50   0.15600 -1.0 2.0
   43    45    47    50   0.53150  1.0 3.0
   43    45    49    52  -0.62250  1.0 1.0
   43    45    49    52  -0.38450 -1.0 2.0
   43    45    49    52   0.81900  1.0 3.0
   44    43    45    46   0.33100  1.0 3.0
   44    43    45    47   0.00000  1.0 1.0
   44    43    45    49   0.00000  1.0 1.0
   45    47    50    51  -0.11600  1.0 1.0
   45    47    50    51  -0.09450 -1.0 2.0
   45    47    50    51   0.21250  1.0 3.0
   45    49    52    53   0.32350  1.0 3.0
   45    49    52    54   0.32350  1.0 3.0
   45    49    52    55   0.01700  1.0 1.0
   45    49    52    55  -0.23550 -1.0 2.0
   45    49    52    55   0.21350  1.0 3.0
   46    45    47    33   0.15000  1.0 3.0
   46    45    47    48   0.15000  1.0 3.0
   46    45    47    50   0.23400  1.0 3.0
   46    45    49    52   0.32350  1.0 3.0
   47    33    38    39   0.62750  1.0 1.0
   47    33    38    39  -0.30950 -1.0 2.0
   47    33    38    39   0.27300  1.0 3.0
   47    33    38    40   0.15000  1.0 3.0
   47    33   -38    41   0.34400  1.0 1.0
   47    33   -38    41   0.09450 -1.0 2.0
   47    33   -38    41   0.11100  1.0 3.0
   47    45    49    52   0.01700  1.0 1.0
   47    45    49    52  -0.23550 -1.0 2.0
   47    45    49    52   0.21350  1.0 3.0
   48    47    50    51   0.19450  1.0 3.0
   49    45    47    33   0.44750  1.0 1.0
   49    45    47    33  -0.17800 -1.0 2.0
   49    45    47    33   0.20200  1.0 3.0
   49    45    47    48   0.15000  1.0 3.0
   49    45    47    50   0.56750  1.0 1.0
   49    45    47    50  -0.07550 -1.0 2.0
   49    45    47    50   0.20000  1.0 3.0
   49    52    55    56   0.15000  1.0 3.0
   49    52    55    57   0.15000  1.0 3.0
   49    52    55    58   0.44750  1.0 1.0
   49    52    55    58  -0.17800 -1.0 2.0
   49    52    55    58   0.20200  1.0 3.0
   52    55    58    59   0.56750  1.0 1.0
   52    55    58    59  -0.07550 -1.0 2.0
   52    55    58    59   0.20000  1.0 3.0
   52    55    58    64   0.56750  1.0 1.0
   52    55    58    64  -0.07550 -1.0 2.0
   52    55    58    64   0.20000  1.0 3.0
   52    55    58    60   0.56750  1.0 1.0
   52    55    58    60  -0.07550 -1.0 2.0
   52    55    58    60   0.20000  1.0 3.0
   53    52    55    56   0.15000  1.0 3.0
   53    52    55    57   0.15000  1.0 3.0
   53    52    55    58   0.15000  1.0 3.0
   54    52    55    56   0.15000  1.0 3.0
   54    52    55    57   0.15000  1.0 3.0
   54    52    55    58   0.15000  1.0 3.0
   55    58   -59    64   0.00000  1.0 1.0
   55    58   -64    59   0.00000  1.0 1.0
   55    58    60    61   0.15000  1.0 3.0
   55    58    60    62   0.15000  1.0 3.0
   55    58    60    63   0.15000  1.0 3.0
   56    55    58    59   0.15000  1.0 3.0
   56    55    58    64   0.15000  1.0 3.0
   56    55    58    60   0.15000  1.0 3.0
   57    55    58    59   0.15000  1.0 3.0
   57    55    58    64   0.15000  1.0 3.0
   57    55    58    60   0.15000  1.0 3.0
   59    58    60    61   0.15000  1.0 3.0
   59    58    60    62   0.15000  1.0 3.0
   59    58    60    63   0.15000  1.0 3.0
   64    58    60    61   0.15000  1.0 3.0
   64    58    60    62   0.15000  1.0 3.0
   64    58    60    63   0.15000  1.0 3.0
   60    58   -59    64   0.00000  1.0 1.0
   60    58   -64    59   0.00000  1.0 1.0
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
   36    30    35    37  10.50000 -1.0 2.0
   38    42    41    43   1.10000 -1.0 2.0
   45    44    43    41   1.10000 -1.0 2.0
END
