* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    118    193     351
    1     0 S   NP   _N1_     1    28.88253    94.71722   -19.75361
    2     1 S   H    _HN1     2     1.02962    97.71387    30.43050
    3     1 S   H    _H1_     3     1.02838    35.90615   139.02414
    4     1 S   H    _H2_     4     1.02780    78.63770   -76.76494
    5     1 S   CT   _CA1     5     1.50085   143.43240   171.15424
    6     5 S   HC   _HA1     6     1.09570   105.32216    39.86168
    7     5 S   CO3  _C1_     7     1.53823   112.21434   -80.50393
    8     7 S   O2Z  _O11     8     1.26367   115.06996   -48.24266
    9     7 S   O2Z  _O12     9     1.26229   114.92778   130.98676
   10     5 S   CT   _CB1    10     1.53062   107.42930   157.80669
   11    10 S   HC   HB11    11     1.09818   109.56435   -50.57784
   12    10 S   HC   HB12    12     1.09834   110.30545    65.98153
   13    10 S   CT   _CG1    13     1.53014   112.60661  -171.71492
   14    13 S   HC   HG11    14     1.09594   110.28024   -57.52416
   15    13 S   HC   HG12    15     1.09603   110.28775    61.71858
   16    13 S   C    _CD1    16     1.51747   111.91717  -177.93313
   17    16 S   O    _OE1    17     1.22745   123.15390   -14.88860
   18    16 S   N    _N2_    18     1.38602   111.75044   165.31796
   19    18 S   H    _HN2    19     1.01582   119.07283     3.07415
   20    18 S   CT1  _CA2    20     1.46250   123.26336  -173.95020
   21    20 S   HC   _HA2    21     1.09721   109.40584   -16.22470
   22    20 S   C    _C2_    22     1.53292   108.42553  -132.32294
   23    22 S   O    _O2_    23     1.23003   122.27094  -145.01747
   24    20 S   CT   _CB2    32     1.53545   110.98336   105.64729
   25    24 S   HC   HB21    33     1.09575   109.33922    57.03405
   26    24 S   HC   HB22    34     1.09501   110.72511   175.71454
   27    22 S   N    _N3_    24     1.38513   113.29161    42.26808
   28    27 S   H    _HN3    25     1.01539   118.91783    -0.49772
   29    24 S   S    _SG2    35     1.82919   111.55961   -64.34358
   30    27 S   CT   _CA3    26     1.45440   123.36758   175.18415
   31    30 S   HC   HA31    27     1.09529   109.15427    26.07512
   32    30 S   HC   HA32    28     1.09494   107.14982   143.05509
   33    29 S   CT   _C18    36     1.84338    99.92266   152.09486
   34    33 S   HC   _H3_    37     1.09748   107.38264   -41.80075
   35    30 S   CO3  _C3_    29     1.52924   113.14300   -97.34681
   36    35 S   O2Z  _O31    30     1.26399   115.40808   -44.97701
   37    35 S   O2Z  _O32    31     1.26356   114.98210   135.96068
   38    33 S   CA   _C9_    38     1.52097   109.96818    76.64054
   39    33 S   CT   _C17    52     1.54240   110.22841  -158.07984
   40    39 S   HC   _H28    53     1.09637   113.48420   -54.88563
   41    38 S   CA   _C4_    39     1.40634   119.50687  -109.41187
   42    41 S   HA   _H24    40     1.08746   119.80036    -0.16071
   43    39 S   CO4  _C16    54     1.52023   113.27823    70.43461
   44    43 S   O    _O16    55     1.21600   128.25421   -60.93671
   45    41 S   CA   _C11    41     1.39656   120.45263   179.83098
   46    43 S   CA   _C8_    56     1.43846   107.80339   119.28427
   47    45 S   CA   _C15    42     1.39038   120.24359    -0.04423
   48    45 S   OH   _O18    50     1.36731   120.44368   179.97202
   49    48 S   HO   _H30    51     0.97197   108.82668     0.25564
   50    46 S   CA   _C10    57     1.37803   105.53709    -0.68586
   51    47 S   CA   _C12    43     1.39188   119.78404    -0.08156
   52    47 S   OH   _O22    48     1.36722   119.66468   179.97202
   53    52 S   HO   _H34    49     0.97384   107.24848   179.89913
   54    50 S   CA   _C6_    58     1.38181   120.83328  -179.62102
   55    54 S   HA   _H26    59     1.08456   121.15776   179.91377
   56    39 S   OS   _O17    68     1.46028   108.99304  -174.04425
   57    38 S   CA   _C5_    44     1.40599   121.70390    70.22166
   58    57 S   HA   _H25    45     1.08692   120.08295    -0.10835
   59    51 S   OH   _O19    46     1.36777   118.63742  -179.85598
   60    59 S   HO   _H31    47     0.97264   108.62465   179.75531
   61    54 S   CA   _C13    60     1.39654   117.67964    -0.03426
   62    61 S   CA   _C7_    61     1.40459   121.48731    -0.00000
   63    62 S   HA   _H27    62     1.08665   120.52550  -180.00000
   64    61 S   OH   _O20    66     1.36789   117.86323   179.98022
   65    64 S   HO   _H32    67     0.97254   108.56682   180.00000
   66    46 S   CA   _C14    63     1.38000   132.13320   179.63846
   67    66 S   OH   _O21    64     1.35932   123.47106    -0.46688
   68    67 S   HO   _H33    65     0.97584   109.82456    -1.55972
  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
  15   7   2   1   1  13  10   5   9   4   8   4   8  10   9   3
   1   8   6   3   1   8   4   2   3   1   1   1   6   6   3   2
   1   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    57    39    40    43    56  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    51    57    58    39    40    43    44    46    50    56  
   38    41    57    39    40    43    56  
   36    37  
   37  
    0  
   41    42    45    47    51    57    58    59    48    39    40    43    56  
   40    43    44    46    50    54    66    56    41    57  
   43    44    46    50    56  
   42    45    47    51    57    58    52    48    49  
   45    47    57    48  
   44    46    50    54    62    66    67    56  
   46    50    66    56  
   47    51    57    59    52    53    48    49  
   50    54    55    61    62    63    66    67    68    56  
   51    57    58    59    60    52    53    48    49  
   49    51    52  
    0  
   54    55    61    62    66    67    64    56  
   57    58    59    60    52    53  
   53    57    59  
    0  
   55    61    62    63    66    64    65    56  
   61    62    64    56  
   61    66  
   58    59    60  
   59  
   60  
    0  
   62    63    66    67    64    65  
   63    66    67    68    64    65  
   66    67    64  
   65    66  
    0  
   67    68  
   68  
    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   0.222500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660   0.218000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.7500   0.1050   0.537000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   48   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   52   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   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   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   65   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   66   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   67   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   68   0.5000   0.0300   0.435000   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  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    57   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    47   469.000  1.400
   45    48   450.000  1.364
   47    51   469.000  1.400
   47    52   450.000  1.364
   51    57   469.000  1.400
   51    59   450.000  1.364
   57    58   367.000  1.080
   59    60   553.000  0.945
   52    53   553.000  0.945
   48    49   553.000  0.945
   39    40   340.000  1.090
   39    43   317.000  1.522
   39    56   320.000  1.410
   43    44   570.000  1.229
   43    46   310.000  1.470
   46    50   469.000  1.400
   46    66   469.000  1.400
   50    54   469.000  1.400
   50    56   450.000  1.364
   54    55   367.000  1.080
   54    61   469.000  1.400
   61    62   469.000  1.400
   61    64   450.000  1.364
   62    63   367.000  1.080
   62    66   469.000  1.400
   66    67   450.000  1.364
   67    68   553.000  0.945
   64    65   553.000  0.945
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    57    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    63.00000  111.10000
   33    39    56    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    57    51    63.00000  120.00000
   38    57    58    35.00000  120.00000
   41    45    47    63.00000  120.00000
   41    45    48    70.00000  120.00000
   45    41    42    35.00000  120.00000
   45    47    51    63.00000  120.00000
   45    47    52    70.00000  120.00000
   45    48    49    35.00000  113.00000
   47    51    57    63.00000  120.00000
   47    51    59    70.00000  120.00000
   47    52    53    35.00000  113.00000
   51    57    58    35.00000  120.00000
   51    59    60    35.00000  113.00000
   57    38    41    63.00000  120.00000
   59    51    57    70.00000  120.00000
   52    47    51    70.00000  120.00000
   48    45    47    70.00000  120.00000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    44    80.00000  120.40000
   39    43    46    65.00000  115.47100
   39    56    50    75.00000  111.00000
   43    39    40    35.00000  109.50000
   43    46    50    60.00000  119.52600
   43    46    66    60.00000  119.52600
   46    43    44    75.00000  123.78400
   46    50    54    63.00000  120.00000
   46    50    56    70.00000  120.00000
   46    66    62    63.00000  120.00000
   46    66    67    70.00000  120.00000
   50    54    55    35.00000  120.00000
   50    54    61    63.00000  120.00000
   54    61    62    63.00000  120.00000
   54    61    64    70.00000  120.00000
   61    54    55    35.00000  120.00000
   61    62    63    35.00000  120.00000
   61    62    66    63.00000  120.00000
   61    64    65    35.00000  113.00000
   62    66    67    70.00000  120.00000
   66    46    50    63.00000  120.00000
   66    62    63    35.00000  120.00000
   66    67    68    35.00000  113.00000
   64    61    62    70.00000  120.00000
   56    39    40    35.00000  109.50000
   56    39    43    90.00000  108.74100
   56    50    54    70.00000  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   0.01700  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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    57  -0.16000  1.0 1.0
   29    33    38    57  -0.03200 -1.0 2.0
   29    33    38    57   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   29    33    39    56   0.56750  1.0 1.0
   29    33    39    56  -0.07550 -1.0 2.0
   29    33    39    56   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    57    51   3.62500 -1.0 2.0
   33    38    57    58   3.62500 -1.0 2.0
   33    39    43    44   0.30150 -1.0 2.0
   33    39    43    46   0.05850 -1.0 2.0
   33    39    43    46   0.17250  1.0 3.0
   33    39    56    50  -0.32850  1.0 1.0
   33    39    56    50  -0.35800 -1.0 2.0
   33    39    56    50   0.33950  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    57   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43  -0.11250  1.0 3.0
   34    33    39    56   0.23400  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  1.0 3.0
   38    33    39    56  -0.64350  1.0 1.0
   38    33    39    56  -0.04200 -1.0 2.0
   38    33    39    56   0.19800  1.0 3.0
   38    41    45    47   3.62500 -1.0 2.0
   38    41    45    48   3.62500 -1.0 2.0
   41    38    57    51   3.62500 -1.0 2.0
   41    38    57    58   3.62500 -1.0 2.0
   41    45   -47    51   3.62500 -1.0 2.0
   41    45    47    52   3.62500 -1.0 2.0
   41    45    48    49   0.84100 -1.0 2.0
   42    41    45    47   3.62500 -1.0 2.0
   42    41    45    48   3.62500 -1.0 2.0
   45    47    51    57   3.62500 -1.0 2.0
   45    47    51    59   3.62500 -1.0 2.0
   45    47    52    53   0.84100 -1.0 2.0
   47    45    48    49   0.84100 -1.0 2.0
   47    51   -57    38   3.62500 -1.0 2.0
   47    51    57    58   3.62500 -1.0 2.0
   47    51    59    60   0.84100 -1.0 2.0
   51    47    52    53   0.84100 -1.0 2.0
   57    38    41    42   3.62500 -1.0 2.0
   57    38   -41    45   3.62500 -1.0 2.0
   57    51    59    60   0.84100 -1.0 2.0
   59    51    57    38   3.62500 -1.0 2.0
   59    51    57    58   3.62500 -1.0 2.0
   52    47    51    57   3.62500 -1.0 2.0
   52    47    51    59   3.62500 -1.0 2.0
   48    45    47    51   3.62500 -1.0 2.0
   48    45    47    52   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    57   0.04150 -1.0 2.0
   39    43   -46    50   2.26350  1.0 1.0
   39    43   -46    50   0.76750 -1.0 2.0
   39    43   -46    50   0.22500  1.0 3.0
   39    43    46    66   2.26350  1.0 1.0
   39    43    46    66   0.76750 -1.0 2.0
   39    43    46    66   0.22500  1.0 3.0
   40    39    43    44   0.00000  1.0 1.0
   40    39    43    46   0.00000  1.0 1.0
   40    39    56    50   0.08050  1.0 3.0
   43    39   -56    50  -0.25600  1.0 1.0
   43    39   -56    50  -0.40050 -1.0 2.0
   43    39   -56    50   0.34700  1.0 3.0
   43    46    50    54   3.62500 -1.0 2.0
   43    46   -50    56   3.62500 -1.0 2.0
   43    46    66    62   3.62500 -1.0 2.0
   43    46    66    67   3.62500 -1.0 2.0
   44    43    46    50   1.05000 -1.0 2.0
   44    43    46    66   1.05000 -1.0 2.0
   46    50    54    55   3.62500 -1.0 2.0
   46    50    54    61   3.62500 -1.0 2.0
   46    50   -56    39   1.63200 -1.0 2.0
   46    66    67    68   0.84100 -1.0 2.0
   50    46    66    62   3.62500 -1.0 2.0
   50    46    66    67   3.62500 -1.0 2.0
   50    54   -61    62   3.62500 -1.0 2.0
   50    54    61    64   3.62500 -1.0 2.0
   54    50    56    39   1.63200 -1.0 2.0
   54    61    62    63   3.62500 -1.0 2.0
   54    61    62    66   3.62500 -1.0 2.0
   54    61    64    65   0.84100 -1.0 2.0
   55    54    61    62   3.62500 -1.0 2.0
   55    54    61    64   3.62500 -1.0 2.0
   61    62   -66    46   3.62500 -1.0 2.0
   61    62    66    67   3.62500 -1.0 2.0
   62    61    64    65   0.84100 -1.0 2.0
   62    66    67    68   0.84100 -1.0 2.0
   63    62    66    46   3.62500 -1.0 2.0
   63    62    66    67   3.62500 -1.0 2.0
   66    46   -50    54   3.62500 -1.0 2.0
   66    46    50    56   3.62500 -1.0 2.0
   64    61    62    63   3.62500 -1.0 2.0
   64    61    62    66   3.62500 -1.0 2.0
   56    39    43    44   0.30150 -1.0 2.0
   56    39   -43    46   0.65300  1.0 1.0
   56    39   -43    46  -0.03850 -1.0 2.0
   56    39   -43    46   0.33900  1.0 3.0
   56    50    54    55   3.62500 -1.0 2.0
   56    50    54    61   3.62500 -1.0 2.0
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
   41    57    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   47    48    45    41   4.00000 -1.0 2.0
   51    52    47    45   4.00000 -1.0 2.0
   57    59    51    47   4.00000 -1.0 2.0
   51    58    57    38   1.10000 -1.0 2.0
   39    46    43    44  10.50000 -1.0 2.0
   50    66    46    43   4.00000 -1.0 2.0
   54    56    50    46   4.00000 -1.0 2.0
   61    55    54    50   1.10000 -1.0 2.0
   62    64    61    54   4.00000 -1.0 2.0
   66    63    62    61   1.10000 -1.0 2.0
   62    67    66    46   4.00000 -1.0 2.0
END
