* LIGAND DATABASE FILE (OPLS2005)
*
001      66    66    118    178     349
    1     0 S   NP   _N1_     1    29.17240    94.56249   -19.65553
    2     1 S   H    _HN1     2     1.02752    82.36476   -62.90508
    3     1 S   H    _H1_     3     1.02975    96.41692    44.88410
    4     1 S   H    _H2_     4     1.02800    33.33149   156.24559
    5     1 S   CT   _CA1     5     1.50313   142.28758  -179.85329
    6     5 S   HC   _HA1     6     1.09602   104.98033    45.52978
    7     5 S   CO3  _C1_     7     1.53873   112.51181   -73.69156
    8     7 S   O2Z  _O11     8     1.26369   115.05198   -33.20978
    9     7 S   O2Z  _O12     9     1.26289   114.96344   145.05012
   10     5 S   CT   _CB1    10     1.53056   107.08415   162.86957
   11    10 S   HC   HB11    11     1.09802   108.78987   -51.66825
   12    10 S   HC   HB12    12     1.09783   110.37968    64.46520
   13    10 S   CT   _CG1    13     1.52973   113.11779  -173.14494
   14    13 S   HC   HG11    14     1.09544   110.15440   -68.67497
   15    13 S   HC   HG12    15     1.09662   110.20067    50.19483
   16    13 S   C    _CD1    16     1.51967   112.33320   169.53260
   17    16 S   O    _OE1    17     1.22792   123.06568   -19.72522
   18    16 S   N    _N2_    18     1.38581   111.94243   162.82849
   19    18 S   H    _HN2    19     1.01574   118.99171    -2.61292
   20    18 S   CT1  _CA2    20     1.46272   123.52967   176.55411
   21    20 S   HC   _HA2    21     1.09753   109.27588    -9.62553
   22    20 S   C    _C2_    22     1.53486   108.21519  -124.65915
   23    22 S   O    _O2_    23     1.23015   122.60714  -148.21896
   24    20 S   CT   _CB2    32     1.53319   111.60128   112.56662
   25    24 S   HC   HB21    33     1.09485   109.87200    53.84005
   26    24 S   HC   HB22    34     1.09490   110.53539   172.14332
   27    22 S   N    _N3_    24     1.38490   113.47995    39.66094
   28    27 S   H    _HN3    25     1.01640   119.45511    -4.23360
   29    24 S   S    _SG2    35     1.82951   111.16535   -69.40953
   30    27 S   CT   _CA3    26     1.45271   122.94876   176.65373
   31    30 S   HC   HA31    27     1.09560   107.63801   -60.63846
   32    30 S   HC   HA32    28     1.09563   107.78483    55.69519
   33    29 S   CT   _C10    36     1.85014   100.56055   126.40037
   34    33 S   HC   _H5_    37     1.09600   107.04176   -37.10845
   35    30 S   CO3  _C3_    29     1.52886   114.30037   177.63016
   36    35 S   O2Z  _O31    30     1.26341   116.12171     0.26467
   37    35 S   O2Z  _O32    31     1.26447   114.38227  -179.72375
   38    33 S   CT   _C9_    38     1.54213   107.72398  -155.61084
   39    38 S   HC   _H4_    39     1.09945   109.49115   -54.08838
   40    38 S   CT   _C8_    40     1.53903   112.08588  -174.03714
   41    40 S   HC   _H10    41     1.09822   109.00147   174.10163
   42    40 S   HC   _H11    42     1.09799   110.24391   -69.19715
   43    38 S   CO3  _C13    64     1.54371   114.09017    67.99398
   44    43 S   O2Z  _O42    65     1.26295   116.14708    39.81644
   45    43 S   O2Z  _O41    66     1.26522   114.66032  -140.70515
   46    40 S   CT   _C7_    43     1.53525   112.66046    52.98260
   47    46 S   HC   _H3_    44     1.09835   106.85543  -173.51318
   48    46 S   CT   _C12    45     1.53530   110.41277   -54.08600
   49    48 S   HC   _H7_    46     1.09463   110.64326   177.86439
   50    46 S   OS   _O35    56     1.43596   107.88902    66.71098
   51    33 S   CT   _C11    47     1.54439   110.63344    82.76320
   52    51 S   HC   _H6_    48     1.09754   109.62131    53.98199
   53    48 S   OH   _O36    54     1.43179   108.98233   -65.13538
   54    53 S   HO   _H12    55     0.97208   107.19055   -64.25119
   55    50 S   CM   _C5_    57     1.38281   112.77080   151.22075
   56    51 S   OS   _O37    49     1.42962   110.08450   -66.31809
   57    55 S   CM   _C4_    58     1.33747   120.55396   115.45813
   58    57 S   HC   _H8_    59     1.08565   120.51468    -3.15231
   59    57 S   HC   _H9_    60     1.08428   122.02818   177.34347
   60    55 S   CO3  _C6_    61     1.54542   118.41313   -69.67058
   61    60 S   O2Z  _O34    62     1.26516   115.92917   153.79507
   62    60 S   O2Z  _O33    63     1.26566   115.14679   -25.91752
   63    56 S   P3   _P1_    50     1.64976   119.66125   137.88071
   64    63 S   O2Z  _O39    51     1.52528   103.44726   178.03218
   65    63 S   O2Z  _O40    52     1.52501   104.91131    58.28959
   66    63 S   O2Z  _O38    53     1.52506   104.76490   -62.32634
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  17   8   2   1   1  14   8  13   6   5   4   1   1  12   6   9
   6   9   8   3   2   1   6   4   5   2   1   2   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    51    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    48    51    52    56    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    46    48    49    51    52    56    63    53    43    44    45  
   38    39    40    48    51    52    56    43  
   36    37  
   37  
    0  
   39    40    41    42    46    47    48    51    52    56    50    43    44    45  
   40    41    42    46    51    43    44    45  
   41    42    46    47    48    49    51    53    50    55    43    44    45  
   42    46    47    48    50    43  
   46    47    48    50    43  
   44    45    46    51  
   45  
    0  
   47    48    49    51    52    56    53    54    50    55    57    60  
   48    49    51    53    50    55  
   49    51    52    56    63    53    54    50    55  
   51    52    56    53    54    50  
   55    57    58    59    60    61    62    51    53  
   52    56    63    64    65    66    53    54  
   56    63    53  
   54    56  
    0  
   57    58    59    60    61    62  
   63    64    65    66  
   58    59    60    61    62  
   59    60  
   60  
   61    62  
   62  
    0  
   64    65    66  
   65    66  
   66  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   51   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5500   0.0760  -0.225300   2.0020   1.7750   0.023028004  -0.852763146
   56   2.8500   0.1400  -0.760000   1.5900   1.4000   0.020110767  -0.896042159
   57   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   60   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   63   3.7400   0.2000   1.919900   2.1070   1.8700   0.005000000   0.000000000
   64   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   65   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   66   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   268.000  1.529
   33    51   268.000  1.529
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    43   317.000  1.522
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    46   268.000  1.529
   46    47   340.000  1.090
   46    48   268.000  1.529
   46    50   320.000  1.410
   48    49   340.000  1.090
   48    51   268.000  1.529
   48    53   320.000  1.410
   51    52   340.000  1.090
   51    56   320.000  1.410
   56    63   230.000  1.630
   63    64   525.000  1.516
   63    65   525.000  1.516
   63    66   525.000  1.516
   53    54   553.000  0.945
   50    55   440.000  1.360
   55    57   549.000  1.340
   55    60   230.000  1.545
   57    58   340.000  1.080
   57    59   340.000  1.080
   60    61   656.000  1.250
   60    62   656.000  1.250
   43    44   656.000  1.250
   43    45   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    51    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    43    70.00000  109.69300
   33    51    48    58.35000  112.70000
   33    51    52    37.50000  110.70000
   33    51    56    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    42    37.50000  110.70000
   38    40    46    58.35000  112.70000
   38    43    44    70.00000  117.00000
   38    43    45    70.00000  117.00000
   40    38    39    37.50000  110.70000
   40    46    47    37.50000  110.70000
   40    46    48    58.35000  112.70000
   40    46    50    50.00000  109.50000
   42    40    41    33.00000  107.80000
   46    40    41    37.50000  110.70000
   46    40    42    37.50000  110.70000
   46    48    49    37.50000  110.70000
   46    48    51    58.35000  112.70000
   46    48    53    50.00000  109.50000
   46    50    55    90.00000  111.18400
   48    46    47    37.50000  110.70000
   48    51    52    37.50000  110.70000
   48    51    56    50.00000  109.50000
   48    53    54    55.00000  108.50000
   51    33    34    37.50000  110.70000
   51    33    38    58.35000  112.70000
   51    48    49    37.50000  110.70000
   51    56    63    80.00000  112.68000
   56    51    52    35.00000  109.50000
   56    63    64   100.00000  107.00000
   56    63    65   100.00000  107.00000
   56    63    66   100.00000  107.00000
   65    63    64   140.00000  114.00000
   66    63    64   140.00000  114.00000
   66    63    65   140.00000  114.00000
   53    48    49    35.00000  109.50000
   53    48    51    50.00000  109.50000
   50    46    47    35.00000  109.50000
   50    46    48    50.00000  109.50000
   50    55    57    80.00000  120.01400
   50    55    60    80.00000  119.00000
   55    57    58    35.00000  120.00000
   55    57    59    35.00000  120.00000
   55    60    61    85.00000  113.83300
   55    60    62    85.00000  113.83300
   59    57    58    35.00000  117.00000
   60    55    57    55.00000  124.75400
   62    60    61    80.00000  126.00000
   43    38    39    35.00000  109.50000
   43    38    40    70.00000  109.69300
   45    43    44    80.00000  126.00000
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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    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
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    51    48   0.44750  1.0 1.0
   29    33    51    48  -0.17800 -1.0 2.0
   29    33    51    48   0.20200  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    56   0.56750  1.0 1.0
   29    33    51    56  -0.07550 -1.0 2.0
   29    33    51    56   0.20000  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    42   0.15000  1.0 3.0
   33    38    40    46   0.56750  1.0 1.0
   33    38    40    46  -0.07550 -1.0 2.0
   33    38    40    46   0.20000  1.0 3.0
   33    38    43    44   0.41150 -1.0 2.0
   33    38    43    45   0.41150 -1.0 2.0
   33    51    56    63  -2.65550  1.0 1.0
   33    51    56    63  -0.22350 -1.0 2.0
   33    51    56    63   0.24150  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    43  -0.11250  1.0 3.0
   34    33    51    48   0.15000  1.0 3.0
   34    33    51    52   0.15000  1.0 3.0
   34    33    51    56   0.23400  1.0 3.0
   38    33    51    48   0.56750  1.0 1.0
   38    33    51    48  -0.07550 -1.0 2.0
   38    33    51    48   0.20000  1.0 3.0
   38    33    51    52   0.15000  1.0 3.0
   38    33    51    56   0.62750  1.0 1.0
   38    33    51    56  -0.30950 -1.0 2.0
   38    33    51    56   0.27300  1.0 3.0
   38    40    46    47   0.15000  1.0 3.0
   38    40   -46    48   0.56750  1.0 1.0
   38    40   -46    48  -0.07550 -1.0 2.0
   38    40   -46    48   0.20000  1.0 3.0
   38    40    46    50   0.62750  1.0 1.0
   38    40    46    50  -0.30950 -1.0 2.0
   38    40    46    50   0.27300  1.0 3.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    42   0.15000  1.0 3.0
   39    38    40    46   0.15000  1.0 3.0
   39    38    43    44   0.00000  1.0 1.0
   39    38    43    45   0.00000  1.0 1.0
   40    38    43    44   0.41150 -1.0 2.0
   40    38    43    45   0.41150 -1.0 2.0
   40    46    48    49   0.15000  1.0 3.0
   40    46    48    51   0.56750  1.0 1.0
   40    46    48    51  -0.07550 -1.0 2.0
   40    46    48    51   0.20000  1.0 3.0
   40    46    48    53   0.86500  1.0 1.0
   40    46    48    53  -0.17500 -1.0 2.0
   40    46    48    53   0.20800  1.0 3.0
   40    46    50    55  -0.46850  1.0 1.0
   40    46    50    55   0.09300 -1.0 2.0
   40    46    50    55  -0.12850  1.0 3.0
   41    40    46    47   0.15000  1.0 3.0
   41    40    46    48   0.15000  1.0 3.0
   41    40    46    50   0.23400  1.0 3.0
   42    40    46    47   0.15000  1.0 3.0
   42    40    46    48   0.15000  1.0 3.0
   42    40    46    50   0.23400  1.0 3.0
   46    48   -51    33   0.56750  1.0 1.0
   46    48   -51    33  -0.07550 -1.0 2.0
   46    48   -51    33   0.20000  1.0 3.0
   46    48    51    52   0.15000  1.0 3.0
   46    48    51    56   0.62750  1.0 1.0
   46    48    51    56  -0.30950 -1.0 2.0
   46    48    51    56   0.27300  1.0 3.0
   46    48    53    54  -0.11600  1.0 1.0
   46    48    53    54  -0.09450 -1.0 2.0
   46    48    53    54   0.21250  1.0 3.0
   46    50    55    57  -2.26850  1.0 1.0
   46    50    55    57   3.39050 -1.0 2.0
   46    50    55    60   0.15100 -1.0 2.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    51   0.15000  1.0 3.0
   47    46    48    53   0.23400  1.0 3.0
   47    46    50    55   0.08050  1.0 3.0
   48    46    50    55  -0.46850  1.0 1.0
   48    46    50    55   0.09300 -1.0 2.0
   48    46    50    55  -0.12850  1.0 3.0
   48    51    56    63  -2.65550  1.0 1.0
   48    51    56    63  -0.22350 -1.0 2.0
   48    51    56    63   0.24150  1.0 3.0
   49    48    51    33   0.15000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    56   0.23400  1.0 3.0
   49    48    53    54   0.19450  1.0 3.0
   51    33    38    39   0.15000  1.0 3.0
   51    33   -38    40   0.56750  1.0 1.0
   51    33   -38    40  -0.07550 -1.0 2.0
   51    33   -38    40   0.20000  1.0 3.0
   51    33    38    43  -1.63150  1.0 1.0
   51    33    38    43  -0.43550 -1.0 2.0
   51    33    38    43   0.24500  1.0 3.0
   51    48    53    54  -0.11600  1.0 1.0
   51    48    53    54  -0.09450 -1.0 2.0
   51    48    53    54   0.21250  1.0 3.0
   51    56    63    64   0.00000  1.0 1.0
   51    56    63    65   0.00000  1.0 1.0
   51    56    63    66   0.00000  1.0 1.0
   52    51    56    63   0.03000  1.0 3.0
   53    48    51    33   0.86500  1.0 1.0
   53    48    51    33  -0.17500 -1.0 2.0
   53    48    51    33   0.20800  1.0 3.0
   53    48    51    52   0.23400  1.0 3.0
   53    48    51    56   3.69350  1.0 1.0
   53    48    51    56  -1.82950 -1.0 2.0
   50    46    48    49   0.23400  1.0 3.0
   50    46    48    51   0.62750  1.0 1.0
   50    46    48    51  -0.30950 -1.0 2.0
   50    46    48    51   0.27300  1.0 3.0
   50    46    48    53   3.69350  1.0 1.0
   50    46    48    53  -1.82950 -1.0 2.0
   50    55    57    58   7.00000 -1.0 2.0
   50    55    57    59   7.00000 -1.0 2.0
   50    55    60    61  -0.11900  1.0 1.0
   50    55    60    61   0.76850 -1.0 2.0
   50    55    60    61   0.14100  1.0 3.0
   50    55    60    62  -0.11900  1.0 1.0
   50    55    60    62   0.76850 -1.0 2.0
   50    55    60    62   0.14100  1.0 3.0
   57    55    60    61  -0.04000 -1.0 2.0
   57    55    60    61  -0.29050  1.0 3.0
   57    55    60    62  -0.04000 -1.0 2.0
   57    55    60    62  -0.29050  1.0 3.0
   60    55    57    58   7.00000 -1.0 2.0
   60    55    57    59   7.00000 -1.0 2.0
   43    38    40    41  -0.11250  1.0 3.0
   43    38    40    42  -0.11250  1.0 3.0
   43    38    40    46  -1.63150  1.0 1.0
   43    38    40    46  -0.43550 -1.0 2.0
   43    38    40    46   0.24500  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
   36    30    35    37  10.50000 -1.0 2.0
   50    60    55    57  15.00000 -1.0 2.0
   58    59    57    55  15.00000 -1.0 2.0
   61    55    60    62  10.50000 -1.0 2.0
   44    38    43    45  10.50000 -1.0 2.0
END
