* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    141    228     424
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02075    53.27725    91.59566
    3     1 S   H    _H1_     3     1.02084    58.86692  -111.95947
    4     1 S   H    _H2_     4     1.02061   106.55571    -9.73579
    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   _C5_    36     1.84959    97.58466  -158.14446
   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   CM   _C16    37     1.50335   107.55395   180.00000
   38    37 S   HC   _H22    38     1.08689   117.96283    60.13039
   39    33 S   CT   _C4_    69     1.53420   106.23414   -60.73863
   40    39 S   HC   _H6_    70     1.08472   109.33850    63.17262
   41    39 S   HC   _H7_    71     1.08588   109.32628   -56.85824
   42    39 S   HC   _H8_    72     1.08609   109.27799  -176.81574
   43    37 S   CM   _C15    39     1.34478   123.40159  -122.02381
   44    43 S   OS   _O33    40     1.38119   123.32600    -2.89962
   45    43 S   OH   _O34    67     1.38391   120.51577   177.03522
   46    45 S   HO   _H23    68     0.96241   109.83899     0.00000
   47    44 S   CT   _C7_    41     1.44606   116.81275   -21.05486
   48    47 S   CT   _C8_    42     1.55864   106.38587   164.57100
   49    48 S   HC   _H11    43     1.09741   110.51937    -8.29848
   50    48 S   HC   _H12    44     1.09377   111.04473  -126.59366
   51    33 S   CT   _C6_    64     1.54047   108.13107    60.56518
   52    51 S   HC   _H9_    65     1.09756   107.43547   -92.20637
   53    51 S   HC   _H10    66     1.09195   110.91019    23.16935
   54    48 S   CT   _C9_    45     1.53527   111.26527   112.90214
   55    54 S   HC   _H3_    46     1.09632   111.98167   179.09216
   56    54 S   CT   _C10    47     1.53172   109.94589   -56.90630
   57    56 S   HC   _H13    48     1.09708   109.91220   -60.42702
   58    56 S   HC   _H14    49     1.09700   110.69315  -177.86457
   59    56 S   CT   _C11    50     1.53087   109.95464    60.73625
   60    59 S   HC   _H15    51     1.09922   109.73628   117.78973
   61    59 S   HC   _H16    52     1.09806   110.15248  -126.21504
   62    47 S   CT   _C12    53     1.56151   108.84404   -79.90627
   63    62 S   HC   _H4_    54     1.09814   110.32588    65.48638
   64    62 S   CT   _C13    55     1.53332   110.27768  -172.60416
   65    64 S   HC   _H17    56     1.09694   111.86093  -179.91153
   66    64 S   HC   _H18    57     1.09425   112.67911   -57.57795
   67    54 S   NP   _N4_    58     1.52770   109.20971    59.69574
   68    67 S   H    _H5_    59     1.03009   105.54753  -170.71748
   69    67 S   CT   _C14    60     1.50277   114.22843    74.84571
   70    69 S   HC   _H19    61     1.09138   107.77686   -65.09696
   71    69 S   HC   _H20    62     1.09221   107.76357    54.92684
   72    69 S   HC   _H21    63     1.09141   107.82741   174.89731
  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  12   5   4   3
  15   2   1   1  13   5   8   3   2   1   7  14   2   1  18  17
   7   6   7   2   1  17   8  11   6   5   8   4   3   7   4   8
   4   3   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    51    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    47    51    52    53    39    40    41    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    43    44    47    48    62    51    52    53    45    39    40    41    42  
   35    36  
   36  
    0  
   38    43    44    47    51    52    53    45    46    39    40    41    42  
   43    44    51    45    39  
   40    41    42    43    47    51    52    53  
   41    42    51  
   42    51  
   51  
   44    47    48    62    51    45    46  
   47    48    49    50    54    59    62    63    64    51    52    53    45    46  
   46    47  
    0  
   48    49    50    54    55    56    59    60    61    62    63    64    65    66    67    51    52    53  
   49    50    54    55    56    57    58    59    62    63    64    67    68    69    51    52    53  
   50    54    55    56    62    67    51  
   54    55    56    62    67    51  
   52    53    54    59    62    63    64  
   53    62  
   62  
   55    56    57    58    59    60    61    62    64    65    66    67    68    69    70    71    72  
   56    57    58    59    64    67    68    69  
   57    58    59    60    61    62    63    64    67    68    69  
   58    59    60    61    62    67  
   59    60    61    62    67  
   60    61    62    63    64    65    66    67  
   61    62    63    64  
   62    63    64  
   63    64    65    66    67    68    69  
   64    65    66    67  
   65    66    67    68    69    70    71    72  
   66    67    68    69  
   67    68    69  
   68    69    70    71    72  
   69    70    71    72  
   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  -0.335000   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   0.167500   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760   0.133800   2.0020   1.7750   0.023028004  -0.852763146
   44   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   45   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   46   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   47   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   64   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   68   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   69   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.6450   1.4500   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  1.510
   33    51   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.080
   37    43   549.000  1.340
   43    44   440.000  1.360
   43    45   510.000  1.338
   44    47   320.000  1.410
   47    48   268.000  1.529
   47    62   268.000  1.529
   47    51   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    54   268.000  1.529
   54    55   340.000  1.090
   54    56   268.000  1.529
   54    67   367.000  1.471
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   268.000  1.529
   62    63   340.000  1.090
   62    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   367.000  1.471
   67    68   434.000  1.010
   67    69   367.000  1.471
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   51    52   340.000  1.090
   51    53   340.000  1.090
   45    46   553.000  0.945
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   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    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  112.20000
   29    33    51    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    35.00000  117.00000
   33    37    43    70.00000  124.00000
   33    51    47    58.35000  112.70000
   33    51    52    37.50000  110.70000
   33    51    53    37.50000  110.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   37    43    44    80.00000  120.01400
   37    43    45    80.00000  121.38400
   43    37    38    35.00000  120.00000
   43    44    47    90.00000  111.18400
   43    45    46    70.00000  107.45700
   44    47    48    50.00000  109.50000
   44    47    62    50.00000  109.50000
   44    47    51    50.00000  109.50000
   47    48    49    37.50000  110.70000
   47    48    50    37.50000  110.70000
   47    48    54    58.35000  112.70000
   47    62    59    58.35000  112.70000
   47    62    63    37.50000  110.70000
   47    62    64    58.35000  112.70000
   47    51    52    37.50000  110.70000
   47    51    53    37.50000  110.70000
   48    54    55    37.50000  110.70000
   48    54    56    58.35000  112.70000
   48    54    67    80.00000  111.20000
   50    48    49    33.00000  107.80000
   54    48    49    37.50000  110.70000
   54    48    50    37.50000  110.70000
   54    56    57    37.50000  110.70000
   54    56    58    37.50000  110.70000
   54    56    59    58.35000  112.70000
   54    67    64    75.00000  113.01200
   54    67    68    35.00000  109.50000
   54    67    69    75.00000  113.01200
   56    54    55    37.50000  110.70000
   56    59    60    37.50000  110.70000
   56    59    61    37.50000  110.70000
   56    59    62    58.35000  112.70000
   58    56    57    33.00000  107.80000
   59    56    57    37.50000  110.70000
   59    56    58    37.50000  110.70000
   59    62    63    37.50000  110.70000
   59    62    64    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    47    48    58.35000  112.70000
   62    59    60    37.50000  110.70000
   62    59    61    37.50000  110.70000
   62    64    65    37.50000  110.70000
   62    64    66    37.50000  110.70000
   62    64    67    80.00000  111.20000
   64    62    63    37.50000  110.70000
   64    67    68    35.00000  109.50000
   64    67    69    75.00000  113.01200
   66    64    65    33.00000  107.80000
   67    54    55    35.00000  109.50000
   67    54    56    80.00000  111.20000
   67    64    65    35.00000  109.50000
   67    64    66    35.00000  109.50000
   67    69    70    35.00000  109.50000
   67    69    71    35.00000  109.50000
   67    69    72    35.00000  109.50000
   69    67    68    35.00000  109.50000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   51    33    37    70.00000  112.02700
   51    47    48    58.35000  112.70000
   51    47    62    58.35000  112.70000
   53    51    52    33.00000  107.80000
   45    43    44   115.00000  116.36000
   39    33    37    70.00000  112.02700
   39    33    51    58.35000  112.70000
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    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    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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   0.21350  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    37    38   0.00000  1.0 1.0
   29    33    37    43   0.42700  1.0 1.0
   29    33    37    43  -0.70350 -1.0 2.0
   29    33    37    43  -0.43150  1.0 3.0
   29    33    51    47   0.44750  1.0 1.0
   29    33    51    47  -0.17800 -1.0 2.0
   29    33    51    47   0.20200  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    53   0.15000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.15000  1.0 3.0
   33    37    43    44   7.00000 -1.0 2.0
   33    37    43    45   7.00000 -1.0 2.0
   37    33    51    47   0.34400  1.0 1.0
   37    33    51    47   0.09450 -1.0 2.0
   37    33    51    47   0.11100  1.0 3.0
   37    33    51    52   0.15000  1.0 3.0
   37    33    51    53   0.15000  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    42   0.15000  1.0 3.0
   37    43   -44    47  -2.26850  1.0 1.0
   37    43   -44    47   3.39050 -1.0 2.0
   37    43    45    46  -0.66100  1.0 1.0
   37    43    45    46   1.20850 -1.0 2.0
   37    43    45    46  -0.36000  1.0 3.0
   38    37    43    44   7.00000 -1.0 2.0
   38    37    43    45   7.00000 -1.0 2.0
   43    44    47    48  -0.46850  1.0 1.0
   43    44    47    48   0.09300 -1.0 2.0
   43    44    47    48  -0.12850  1.0 3.0
   43    44    47    62  -0.46850  1.0 1.0
   43    44    47    62   0.09300 -1.0 2.0
   43    44    47    62  -0.12850  1.0 3.0
   43    44    47    51  -0.46850  1.0 1.0
   43    44    47    51   0.09300 -1.0 2.0
   43    44    47    51  -0.12850  1.0 3.0
   44    43    45    46   2.00000 -1.0 2.0
   44    47    48    49   0.23400  1.0 3.0
   44    47    48    50   0.23400  1.0 3.0
   44    47    48    54   0.62750  1.0 1.0
   44    47    48    54  -0.30950 -1.0 2.0
   44    47    48    54   0.27300  1.0 3.0
   44    47    62    59   0.62750  1.0 1.0
   44    47    62    59  -0.30950 -1.0 2.0
   44    47    62    59   0.27300  1.0 3.0
   44    47    62    63   0.23400  1.0 3.0
   44    47    62    64   0.62750  1.0 1.0
   44    47    62    64  -0.30950 -1.0 2.0
   44    47    62    64   0.27300  1.0 3.0
   44    47   -51    33   0.62750  1.0 1.0
   44    47   -51    33  -0.30950 -1.0 2.0
   44    47   -51    33   0.27300  1.0 3.0
   44    47    51    52   0.23400  1.0 3.0
   44    47    51    53   0.23400  1.0 3.0
   47    48    54    55   0.15000  1.0 3.0
   47    48    54    56   0.56750  1.0 1.0
   47    48    54    56  -0.07550 -1.0 2.0
   47    48    54    56   0.20000  1.0 3.0
   47    48    54    67   1.36600  1.0 1.0
   47    48    54    67  -0.11450 -1.0 2.0
   47    48    54    67   0.24250  1.0 3.0
   47    62    64    65   0.15000  1.0 3.0
   47    62    64    66   0.15000  1.0 3.0
   47    62   -64    67   1.36600  1.0 1.0
   47    62   -64    67  -0.11450 -1.0 2.0
   47    62   -64    67   0.24250  1.0 3.0
   48    47    62    59   0.56750  1.0 1.0
   48    47    62    59  -0.07550 -1.0 2.0
   48    47    62    59   0.20000  1.0 3.0
   48    47    62    63   0.15000  1.0 3.0
   48    47    62    64   0.56750  1.0 1.0
   48    47    62    64  -0.07550 -1.0 2.0
   48    47    62    64   0.20000  1.0 3.0
   48    47    51    33   0.56750  1.0 1.0
   48    47    51    33  -0.07550 -1.0 2.0
   48    47    51    33   0.20000  1.0 3.0
   48    47    51    52   0.15000  1.0 3.0
   48    47    51    53   0.15000  1.0 3.0
   48    54    56    57   0.15000  1.0 3.0
   48    54    56    58   0.15000  1.0 3.0
   48    54   -56    59   0.56750  1.0 1.0
   48    54   -56    59  -0.07550 -1.0 2.0
   48    54   -56    59   0.20000  1.0 3.0
   48    54   -67    64   0.47100  1.0 1.0
   48    54    67    68   0.17350  1.0 3.0
   48    54    67    69   0.47100  1.0 1.0
   49    48    54    55   0.15000  1.0 3.0
   49    48    54    56   0.15000  1.0 3.0
   49    48    54    67   0.19200  1.0 3.0
   50    48    54    55   0.15000  1.0 3.0
   50    48    54    56   0.15000  1.0 3.0
   50    48    54    67   0.19200  1.0 3.0
   54    56    59    60   0.15000  1.0 3.0
   54    56    59    61   0.15000  1.0 3.0
   54    56    59    62   0.56750  1.0 1.0
   54    56    59    62  -0.07550 -1.0 2.0
   54    56    59    62   0.20000  1.0 3.0
   54    67    69    70   0.15000  1.0 3.0
   54    67    69    71   0.15000  1.0 3.0
   54    67    69    72   0.15000  1.0 3.0
   55    54    56    57   0.15000  1.0 3.0
   55    54    56    58   0.15000  1.0 3.0
   55    54    56    59   0.15000  1.0 3.0
   55    54    67    64   0.15000  1.0 3.0
   55    54    67    68   0.13050  1.0 3.0
   55    54    67    69   0.15000  1.0 3.0
   56    54    67    64   0.47100  1.0 1.0
   56    54    67    68   0.17350  1.0 3.0
   56    54    67    69   0.47100  1.0 1.0
   56    59   -62    47   0.56750  1.0 1.0
   56    59   -62    47  -0.07550 -1.0 2.0
   56    59   -62    47   0.20000  1.0 3.0
   56    59    62    63   0.15000  1.0 3.0
   56    59   -62    64   0.56750  1.0 1.0
   56    59   -62    64  -0.07550 -1.0 2.0
   56    59   -62    64   0.20000  1.0 3.0
   57    56    59    60   0.15000  1.0 3.0
   57    56    59    61   0.15000  1.0 3.0
   57    56    59    62   0.15000  1.0 3.0
   58    56    59    60   0.15000  1.0 3.0
   58    56    59    61   0.15000  1.0 3.0
   58    56    59    62   0.15000  1.0 3.0
   59    62    64    65   0.15000  1.0 3.0
   59    62    64    66   0.15000  1.0 3.0
   59    62    64    67   1.36600  1.0 1.0
   59    62    64    67  -0.11450 -1.0 2.0
   59    62    64    67   0.24250  1.0 3.0
   60    59    62    47   0.15000  1.0 3.0
   60    59    62    63   0.15000  1.0 3.0
   60    59    62    64   0.15000  1.0 3.0
   61    59    62    47   0.15000  1.0 3.0
   61    59    62    63   0.15000  1.0 3.0
   61    59    62    64   0.15000  1.0 3.0
   62    47    48    49   0.15000  1.0 3.0
   62    47    48    50   0.15000  1.0 3.0
   62    47   -48    54   0.56750  1.0 1.0
   62    47   -48    54  -0.07550 -1.0 2.0
   62    47   -48    54   0.20000  1.0 3.0
   62    47    51    33   0.56750  1.0 1.0
   62    47    51    33  -0.07550 -1.0 2.0
   62    47    51    33   0.20000  1.0 3.0
   62    47    51    52   0.15000  1.0 3.0
   62    47    51    53   0.15000  1.0 3.0
   62    64   -67    54   0.47100  1.0 1.0
   62    64    67    68   0.17350  1.0 3.0
   62    64    67    69   0.47100  1.0 1.0
   63    62    64    65   0.15000  1.0 3.0
   63    62    64    66   0.15000  1.0 3.0
   63    62    64    67   0.19200  1.0 3.0
   64    67    69    70   0.15000  1.0 3.0
   64    67    69    71   0.15000  1.0 3.0
   64    67    69    72   0.15000  1.0 3.0
   65    64    67    54   0.15000  1.0 3.0
   65    64    67    68   0.13050  1.0 3.0
   65    64    67    69   0.15000  1.0 3.0
   66    64    67    54   0.15000  1.0 3.0
   66    64    67    68   0.13050  1.0 3.0
   66    64    67    69   0.15000  1.0 3.0
   67    54    56    57   0.19200  1.0 3.0
   67    54    56    58   0.19200  1.0 3.0
   67    54   -56    59   1.36600  1.0 1.0
   67    54   -56    59  -0.11450 -1.0 2.0
   67    54   -56    59   0.24250  1.0 3.0
   68    67    69    70   0.13050  1.0 3.0
   68    67    69    71   0.13050  1.0 3.0
   68    67    69    72   0.13050  1.0 3.0
   51    33    37    38   0.00000  1.0 1.0
   51    33   -37    43   0.09850  1.0 1.0
   51    33   -37    43   0.15250 -1.0 2.0
   51    33   -37    43  -0.50650  1.0 3.0
   51    33    39    40   0.15000  1.0 3.0
   51    33    39    41   0.15000  1.0 3.0
   51    33    39    42   0.15000  1.0 3.0
   51    47    48    49   0.15000  1.0 3.0
   51    47    48    50   0.15000  1.0 3.0
   51    47    48    54   0.56750  1.0 1.0
   51    47    48    54  -0.07550 -1.0 2.0
   51    47    48    54   0.20000  1.0 3.0
   51    47    62    59   0.56750  1.0 1.0
   51    47    62    59  -0.07550 -1.0 2.0
   51    47    62    59   0.20000  1.0 3.0
   51    47    62    63   0.15000  1.0 3.0
   51    47    62    64   0.56750  1.0 1.0
   51    47    62    64  -0.07550 -1.0 2.0
   51    47    62    64   0.20000  1.0 3.0
   45    43    44    47   2.00000 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    43   0.09850  1.0 1.0
   39    33    37    43   0.15250 -1.0 2.0
   39    33    37    43  -0.50650  1.0 3.0
   39    33    51    47   0.56750  1.0 1.0
   39    33    51    47  -0.07550 -1.0 2.0
   39    33    51    47   0.20000  1.0 3.0
   39    33    51    52   0.15000  1.0 3.0
   39    33    51    53   0.15000  1.0 3.0
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    38    37    43   1.10000 -1.0 2.0
   44    45    43    37   1.10000 -1.0 2.0
END
