* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    133    204     387
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02125    94.74503   -60.83648
    3     1 S   H    _H1_     3     1.02013    85.40118    47.61059
    4     1 S   H    _H2_     4     1.02110    33.68928  -177.90165
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.06017   107.45539    47.03434
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34107   114.77312   162.49582
   19    18 S   H    _HN2    19     1.04714   118.79755     8.55077
   20    18 S   CT1  _CA2    20     1.46273   126.87342  -171.30195
   21    20 S   HC   _HA2    21     1.08457   106.29775   -11.15208
   22    20 S   C    _C2_    22     1.53997   112.59386  -130.33753
   23    22 S   O    _O2_    23     1.23045   119.06879  -169.67318
   24    20 S   CT   _CB2    32     1.54652   109.47347   105.30358
   25    24 S   HC   HB21    33     1.08610   110.54789    58.78698
   26    24 S   HC   HB22    34     1.08612   109.94660   179.10082
   27    22 S   N    _N3_    24     1.34342   118.95001    10.51681
   28    27 S   H    _HN3    25     1.03492   120.06118     5.01325
   29    24 S   S    _SG2    35     1.81666   112.43212   -61.28423
   30    27 S   CT   _CA3    26     1.46098   124.52762  -172.12615
   31    30 S   HC   HA31    27     1.12298   109.15732    14.27911
   32    30 S   HC   HA32    28     1.12301   109.23063   127.78828
   33    29 S   CT   _C17    36     1.83185    97.78391  -158.16681
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -109.01667
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   CO4  _C16    37     1.53301   105.38521   -60.00189
   38    37 S   O    _O33    38     1.22926   122.81931    88.09166
   39    33 S   OS   _O34    62     1.43672   113.25300    49.96688
   40    37 S   CA   _C15    39     1.48230   117.94494   -89.32244
   41    40 S   CA   _C10    40     1.40218   119.28169   -20.59791
   42    41 S   CA   _C11    41     1.40472   117.75202   177.26856
   43    42 S   HA   _H10    42     1.08726   121.01637  -179.05788
   44    41 S   CM   _C9_    53     1.47485   119.69507    -3.07861
   45    42 S   CA   _C12    43     1.39822   120.99950     1.36974
   46    45 S   HA   _H11    44     1.08734   119.80289   179.64834
   47    33 S   CM   _C8_    54     1.51126   111.11104   179.03876
   48    44 S   OH   _O36    71     1.38252   118.10012  -164.36437
   49    48 S   HO   _H16    72     0.96247   109.88500    -0.00000
   50    45 S   CA   _C13    45     1.39060   120.26353    -0.15949
   51    50 S   HA   _H12    46     1.08650   119.66483  -179.98022
   52    47 S   CT   _C7_    55     1.50848   115.14701   -86.01001
   53    52 S   HC   _H8_    56     1.09491   109.62439    70.90455
   54    52 S   HC   _H9_    57     1.09162   114.00027  -170.41040
   55    40 S   CA   _C14    47     1.40075   119.29952   158.52388
   56    52 S   CT   _C6_    58     1.52213   109.03601   -50.63163
   57    56 S   HC   _H6_    59     1.09696   109.85452   178.09525
   58    56 S   HC   _H7_    60     1.09918   107.95340   -65.91052
   59    55 S   OS   _O35    48     1.36266   122.78642     0.34035
   60    56 S   CT   _C5_    61     1.53591   112.04257    54.74043
   61    59 S   CT   _C18    49     1.42610   117.02099   -89.93590
   62    61 S   HC   _H13    50     1.09256   109.54072   180.00000
   63    61 S   HC   _H14    51     1.09322   109.56323    59.08826
   64    61 S   HC   _H15    52     1.09343   108.93266   -60.44285
   65    60 S   CT   _C4_    63     1.53518   112.00676    73.25754
   66    65 S   HC   _H3_    64     1.08608   109.45338   180.00000
   67    65 S   HC   _H4_    65     1.08619   109.49642    60.03430
   68    65 S   HC   _H5_    66     1.08579   109.46922   -59.97827
   69    60 S   CT   _C19    67     1.53730   108.84780  -167.79723
   70    69 S   HC   _H17    68     1.08491   109.22675   179.97202
   71    69 S   HC   _H18    69     1.08538   109.26400    60.07306
   72    69 S   HC   _H19    70     1.08486   109.29558   -59.97730
  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   2   1   1  12   5  16  12  12   9   4   9   5   3   9   2
   1   4   2   8   5   4   5  11   4   3   4   8   3   2   1   1
   7   3   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    47    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    44    47    52    60    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    55    44    47    52    53    54    56    60    39    65    69    48  
   35    36  
   36  
    0  
   38    40    41    42    50    55    59    44    47    52    60    39  
   40    41    55    47    39  
   65    66    67    68    69    70    71    72    40    44    47    52    56    57    58    60  
   41    42    43    45    50    51    55    59    61    44    47    48  
   42    43    45    46    50    55    59    44    47    52    48    49  
   43    45    46    50    51    55    44    47    48  
   45    46    50    44  
   47    52    53    54    56    48    49    45    55  
   46    50    51    55    59  
   50    51    55  
   52    53    54    56    57    58    60    48    49  
   49    52  
    0  
   51    55    59    61  
   55    59  
   53    54    56    57    58    60    65    69  
   54    56    57    58    60  
   56    57    58    60  
   59    61    62    63    64  
   57    58    60    65    66    67    68    69    70    71    72  
   58    60    65    69  
   60    65    69  
   61    62    63    64  
   65    66    67    68    69    70    71    72  
   62    63    64  
   63    64  
   64  
    0  
   66    67    68    69    70    71    72  
   67    68    69  
   68    69  
   69  
   70    71    72  
   71    72  
   72  
    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  -0.316400   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   0.465900   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.7500   0.1050   0.537000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   48   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5000   0.0660  -0.120000   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   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.522
   33    47   317.000  1.510
   33    39   320.000  1.410
   37    38   570.000  1.229
   37    40   310.000  1.470
   40    41   469.000  1.400
   40    55   469.000  1.400
   41    42   469.000  1.400
   41    44   320.000  1.460
   42    43   367.000  1.080
   42    45   469.000  1.400
   45    46   367.000  1.080
   45    50   469.000  1.400
   50    51   367.000  1.080
   50    55   469.000  1.400
   55    59   450.000  1.364
   59    61   320.000  1.410
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   44    47   549.000  1.340
   44    48   510.000  1.338
   47    52   317.000  1.510
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    56   268.000  1.529
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    60   268.000  1.529
   60    39   320.000  1.410
   60    65   268.000  1.529
   60    69   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   48    49   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   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    37    75.00000  110.18000
   29    33    47    75.00000  112.20000
   29    33    39    85.00000  114.68000
   33    37    38    80.00000  120.40000
   33    37    40    65.00000  115.47100
   33    47    44    70.00000  124.00000
   33    47    52    65.00000  117.92700
   33    39    60    60.00000  109.50000
   37    40    41    60.00000  119.52600
   37    40    55    60.00000  119.52600
   40    37    38    75.00000  123.78400
   40    41    42    63.00000  120.00000
   40    41    44    60.00000  120.93500
   40    55    50    63.00000  120.00000
   40    55    59    70.00000  120.00000
   41    42    43    35.00000  120.00000
   41    42    45    63.00000  120.00000
   41    44    47    60.00000  123.20500
   41    44    48    85.00000  114.86500
   42    45    46    35.00000  120.00000
   42    45    50    63.00000  120.00000
   45    42    43    35.00000  120.00000
   45    50    51    35.00000  120.00000
   45    50    55    63.00000  120.00000
   50    45    46    35.00000  120.00000
   50    55    59    70.00000  120.00000
   55    40    41    63.00000  120.00000
   55    50    51    35.00000  120.00000
   55    59    61    75.00000  111.00000
   59    61    62    35.00000  109.50000
   59    61    63    35.00000  109.50000
   59    61    64    35.00000  109.50000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   44    41    42    60.00000  120.93500
   44    47    52    70.00000  124.00000
   44    48    49    70.00000  107.45700
   47    33    37    70.00000  109.06800
   47    52    53    35.00000  109.50000
   47    52    54    35.00000  109.50000
   47    52    56    70.00000  112.02700
   52    56    57    37.50000  110.70000
   52    56    58    37.50000  110.70000
   52    56    60    58.35000  112.70000
   54    52    53    33.00000  107.80000
   56    52    53    37.50000  110.70000
   56    52    54    37.50000  110.70000
   56    60    39    50.00000  109.50000
   56    60    65    58.35000  112.70000
   56    60    69    58.35000  112.70000
   58    56    57    33.00000  107.80000
   60    56    57    37.50000  110.70000
   60    56    58    37.50000  110.70000
   60    65    66    37.50000  110.70000
   60    65    67    37.50000  110.70000
   60    65    68    37.50000  110.70000
   60    69    70    37.50000  110.70000
   60    69    71    37.50000  110.70000
   60    69    72    37.50000  110.70000
   39    33    37    90.00000  108.74100
   39    33    47    85.00000  110.90400
   65    60    39    50.00000  109.50000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   69    60    39    50.00000  109.50000
   69    60    65    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   48    44    47    80.00000  121.38400
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    47  -0.62250  1.0 1.0
   24    29    33    47  -0.38450 -1.0 2.0
   24    29    33    47   0.81900  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  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    37    38   0.30150 -1.0 2.0
   29    33    37    40   0.65300  1.0 1.0
   29    33    37    40  -0.03850 -1.0 2.0
   29    33    37    40   0.33900  1.0 3.0
   29    33    47    44   0.42700  1.0 1.0
   29    33    47    44  -0.70350 -1.0 2.0
   29    33    47    44  -0.43150  1.0 3.0
   29    33    47    52   0.30250  1.0 1.0
   29    33    47    52  -0.14950 -1.0 2.0
   29    33    47    52   0.36900  1.0 3.0
   29    33    39    60   0.14700  1.0 1.0
   29    33    39    60  -1.16150 -1.0 2.0
   29    33    39    60   0.48700  1.0 3.0
   33    37    40    41   2.26350  1.0 1.0
   33    37    40    41   0.76750 -1.0 2.0
   33    37    40    41   0.22500  1.0 3.0
   33    37    40    55   2.26350  1.0 1.0
   33    37    40    55   0.76750 -1.0 2.0
   33    37    40    55   0.22500  1.0 3.0
   33    47    52    53   0.34800  1.0 3.0
   33    47    52    54   0.34800  1.0 3.0
   33    47    52    56   0.46850  1.0 1.0
   33    47    52    56   0.08550 -1.0 2.0
   33    47    52    56   0.09800  1.0 3.0
   37    33    47    44  -0.51250  1.0 1.0
   37    33    47    44  -0.88800 -1.0 2.0
   37    33    47    44   0.08850  1.0 3.0
   37    33    47    52   0.17250  1.0 1.0
   37    33    47    52  -0.04100 -1.0 2.0
   37    33    47    52  -0.33850  1.0 3.0
   37    33    39    60  -1.11000  1.0 1.0
   37    33    39    60   0.50250 -1.0 2.0
   37    33    39    60   0.47450  1.0 3.0
   37    40    41    42   3.62500 -1.0 2.0
   37    40   -41    44   3.62500 -1.0 2.0
   37    40    55    50   3.62500 -1.0 2.0
   37    40    55    59   3.62500 -1.0 2.0
   38    37    40    41   1.05000 -1.0 2.0
   38    37    40    55   1.05000 -1.0 2.0
   40    41    42    43   3.62500 -1.0 2.0
   40    41    42    45   3.62500 -1.0 2.0
   40    41    44    47   0.15800  1.0 1.0
   40    41    44    47   1.85350 -1.0 2.0
   40    41    44    47  -0.48700  1.0 3.0
   40    41    44    48  -0.01750  1.0 1.0
   40    41    44    48  -0.32000 -1.0 2.0
   40    41    44    48   0.00600  1.0 3.0
   40    55    59    61   1.63200 -1.0 2.0
   41    40    55    50   3.62500 -1.0 2.0
   41    40    55    59   3.62500 -1.0 2.0
   41    42    45    46   3.62500 -1.0 2.0
   41    42   -45    50   3.62500 -1.0 2.0
   41    44   -47    33   7.00000 -1.0 2.0
   41    44    47    52   7.00000 -1.0 2.0
   41    44    48    49   2.00000 -1.0 2.0
   42    41    44    47   0.15800  1.0 1.0
   42    41    44    47   1.85350 -1.0 2.0
   42    41    44    47  -0.48700  1.0 3.0
   42    41    44    48  -0.01750  1.0 1.0
   42    41    44    48  -0.32000 -1.0 2.0
   42    41    44    48   0.00600  1.0 3.0
   42    45    50    51   3.62500 -1.0 2.0
   42    45    50    55   3.62500 -1.0 2.0
   43    42    45    46   3.62500 -1.0 2.0
   43    42    45    50   3.62500 -1.0 2.0
   45    50   -55    40   3.62500 -1.0 2.0
   45    50    55    59   3.62500 -1.0 2.0
   46    45    50    51   3.62500 -1.0 2.0
   46    45    50    55   3.62500 -1.0 2.0
   50    55    59    61   1.63200 -1.0 2.0
   51    50    55    40   3.62500 -1.0 2.0
   51    50    55    59   3.62500 -1.0 2.0
   55    40   -41    42   3.62500 -1.0 2.0
   55    40    41    44   3.62500 -1.0 2.0
   55    59    61    62   0.08050  1.0 3.0
   55    59    61    63   0.08050  1.0 3.0
   55    59    61    64   0.08050  1.0 3.0
   44    41    42    43   3.62500 -1.0 2.0
   44    41    42    45   3.62500 -1.0 2.0
   44    47    52    53   0.00000  1.0 1.0
   44    47    52    54   0.00000  1.0 1.0
   44    47    52    56   0.09850  1.0 1.0
   44    47    52    56   0.15250 -1.0 2.0
   44    47    52    56  -0.50650  1.0 3.0
   47    33    37    38   0.30150 -1.0 2.0
   47    33   -37    40   0.65300  1.0 1.0
   47    33   -37    40  -0.03850 -1.0 2.0
   47    33   -37    40   0.33900  1.0 3.0
   47    33    39    60  -0.77900  1.0 1.0
   47    33    39    60  -0.36900 -1.0 2.0
   47    33    39    60   0.40400  1.0 3.0
   47    44    48    49  -0.66100  1.0 1.0
   47    44    48    49   1.20850 -1.0 2.0
   47    44    48    49  -0.36000  1.0 3.0
   47    52    56    57   0.15000  1.0 3.0
   47    52    56    58   0.15000  1.0 3.0
   47    52   -56    60   0.34400  1.0 1.0
   47    52   -56    60   0.09450 -1.0 2.0
   47    52   -56    60   0.11100  1.0 3.0
   52    56    60    39   0.62750  1.0 1.0
   52    56    60    39  -0.30950 -1.0 2.0
   52    56    60    39   0.27300  1.0 3.0
   52    56    60    65   0.56750  1.0 1.0
   52    56    60    65  -0.07550 -1.0 2.0
   52    56    60    65   0.20000  1.0 3.0
   52    56    60    69   0.56750  1.0 1.0
   52    56    60    69  -0.07550 -1.0 2.0
   52    56    60    69   0.20000  1.0 3.0
   53    52    56    57   0.15000  1.0 3.0
   53    52    56    58   0.15000  1.0 3.0
   53    52    56    60   0.15000  1.0 3.0
   54    52    56    57   0.15000  1.0 3.0
   54    52    56    58   0.15000  1.0 3.0
   54    52    56    60   0.15000  1.0 3.0
   56    60   -39    33   0.06250  1.0 1.0
   56    60   -39    33  -0.01100 -1.0 2.0
   56    60   -39    33   0.28050  1.0 3.0
   56    60    65    66   0.15000  1.0 3.0
   56    60    65    67   0.15000  1.0 3.0
   56    60    65    68   0.15000  1.0 3.0
   56    60    69    70   0.15000  1.0 3.0
   56    60    69    71   0.15000  1.0 3.0
   56    60    69    72   0.15000  1.0 3.0
   57    56    60    39   0.23400  1.0 3.0
   57    56    60    65   0.15000  1.0 3.0
   57    56    60    69   0.15000  1.0 3.0
   58    56    60    39   0.23400  1.0 3.0
   58    56    60    65   0.15000  1.0 3.0
   58    56    60    69   0.15000  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    40   0.65300  1.0 1.0
   39    33    37    40  -0.03850 -1.0 2.0
   39    33    37    40   0.33900  1.0 3.0
   39    33    47    44   0.39000  1.0 1.0
   39    33    47    44  -0.05800 -1.0 2.0
   39    33    47    44  -0.55150  1.0 3.0
   39    33   -47    52   0.09700  1.0 1.0
   39    33   -47    52   0.15600 -1.0 2.0
   39    33   -47    52  -0.50800  1.0 3.0
   39    60    65    66   0.23400  1.0 3.0
   39    60    65    67   0.23400  1.0 3.0
   39    60    65    68   0.23400  1.0 3.0
   39    60    69    70   0.23400  1.0 3.0
   39    60    69    71   0.23400  1.0 3.0
   39    60    69    72   0.23400  1.0 3.0
   65    60    39    33   0.06250  1.0 1.0
   65    60    39    33  -0.01100 -1.0 2.0
   65    60    39    33   0.28050  1.0 3.0
   65    60    69    70   0.15000  1.0 3.0
   65    60    69    71   0.15000  1.0 3.0
   65    60    69    72   0.15000  1.0 3.0
   69    60    39    33   0.06250  1.0 1.0
   69    60    39    33  -0.01100 -1.0 2.0
   69    60    39    33   0.28050  1.0 3.0
   69    60    65    66   0.15000  1.0 3.0
   69    60    65    67   0.15000  1.0 3.0
   69    60    65    68   0.15000  1.0 3.0
   48    44    47    33   7.00000 -1.0 2.0
   48    44    47    52   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   33    40    37    38  10.50000 -1.0 2.0
   41    55    40    37   4.00000 -1.0 2.0
   42    44    41    40   4.00000 -1.0 2.0
   45    43    42    41   1.10000 -1.0 2.0
   50    46    45    42   1.10000 -1.0 2.0
   55    51    50    45   1.10000 -1.0 2.0
   50    59    55    40   4.00000 -1.0 2.0
   41    48    44    47   1.10000 -1.0 2.0
   33    52    47    44   1.10000 -1.0 2.0
END
