* LIGAND DATABASE FILE (OPLS2005)
*
001      66    68    120    184     346
    1     0 S   NP   _N1_     1    28.79666    94.71847   -20.23169
    2     1 S   H    _HN1     2     1.02835    32.47669   154.54988
    3     1 S   H    _H1_     3     1.02777    85.75524   -71.79144
    4     1 S   H    _H2_     4     1.02959    92.77917    36.34171
    5     1 S   CT   _CA1     5     1.50137   142.82472   166.29793
    6     5 S   HC   _HA1     6     1.09592   105.19486    52.54861
    7     5 S   CO3  _C1_     7     1.53773   112.11335   -67.36325
    8     7 S   O2Z  _O11     8     1.26337   114.99710   -50.82410
    9     7 S   O2Z  _O12     9     1.26245   114.82182   127.95601
   10     5 S   CT   _CB1    10     1.53086   107.34450   170.05133
   11    10 S   HC   HB11    11     1.09817   109.10680   -52.93931
   12    10 S   HC   HB12    12     1.09816   110.56247    63.53028
   13    10 S   CT   _CG1    13     1.52980   112.67052  -174.17274
   14    13 S   HC   HG11    14     1.09558   110.17262   -65.03139
   15    13 S   HC   HG12    15     1.09645   110.13692    54.05318
   16    13 S   C    _CD1    16     1.51881   112.30185   174.10941
   17    16 S   O    _OE1    17     1.22734   123.20535    -9.28861
   18    16 S   N    _N2_    18     1.38602   111.72154   171.68825
   19    18 S   H    _HN2    19     1.01567   118.91315     0.25256
   20    18 S   CT1  _CA2    20     1.46316   123.50635   179.91607
   21    20 S   HC   _HA2    21     1.09734   109.30424   -16.36405
   22    20 S   C    _C2_    22     1.53445   108.04222  -131.92733
   23    22 S   O    _O2_    23     1.23004   122.31621  -145.47729
   24    20 S   CT   _CB2    32     1.53442   111.56288   105.98623
   25    24 S   HC   HB21    33     1.09598   109.64084    52.99779
   26    24 S   HC   HB22    34     1.09500   110.77836   171.98629
   27    22 S   N    _N3_    24     1.38531   113.30896    41.81558
   28    27 S   H    _HN3    25     1.01533   118.90678    -0.46140
   29    24 S   S    _SG2    35     1.82526   111.87799   -68.30012
   30    27 S   CT   _CA3    26     1.45443   123.45069   175.20404
   31    30 S   HC   HA31    27     1.09522   109.24135    24.30465
   32    30 S   HC   HA32    28     1.09495   107.12174   141.31533
   33    29 S   CT   _C13    36     1.82506    98.89945   164.88867
   34    33 S   HC   _H10    37     1.09308   108.15587   -48.61754
   35    33 S   HC   _H11    38     1.09470   108.47690    68.88612
   36    30 S   CO3  _C3_    29     1.52920   113.10672   -99.17142
   37    36 S   O2Z  _O31    30     1.26401   115.40314   -44.29580
   38    36 S   O2Z  _O32    31     1.26351   114.97699   136.63073
   39    33 S   CT   _C12    39     1.53292   111.04026  -169.87002
   40    39 S   HC   _H5_    40     1.09617   110.37711   -57.49313
   41    39 S   CT   _C11    41     1.53505   111.44315   178.03168
   42    41 S   HC   _H4_    42     1.09739   113.69521    27.89236
   43    41 S   CT   _C10    43     1.51758   102.57801   -92.35001
   44    43 S   HC   _H8_    44     1.09578   109.93304    82.25185
   45    43 S   HC   _H9_    45     1.09460   113.87268  -156.04582
   46    41 S   OS   _O34    63     1.43071   109.72628   153.88836
   47    43 S   CO   _C9_    46     1.51865   101.54213   -35.96423
   48    47 S   HC   _H3_    47     1.09710   110.55773   -82.13444
   49    46 S   PR   _P1_    64     1.62103   117.38746   -99.75555
   50    49 S   OM   _O36    65     1.64064    97.62324  -179.87028
   51    49 S   OM   _O35    66     1.64170    97.88558   -80.70885
   52    47 S   N*   _N6_    48     1.44724   115.25673   155.28230
   53    39 S   OS   _O33    62     1.44600   109.40098    60.72174
   54    52 S   CRAB _C8_    49     1.37091   124.77787   112.89220
   55    54 S   HA   _H7_    50     1.08188   122.49922    -1.20772
   56    54 S   NNA  _N7_    51     1.31573   112.13861   178.52966
   57    56 S   C56B _C6_    52     1.37534   104.97129     0.02798
   58    52 S   C56A _C7_    53     1.36921   128.07489   -68.34925
   59    58 S   NB   _N5_    54     1.34158   128.19946     1.68922
   60    59 S   CQ   _C4_    55     1.34529   110.98381  -179.74666
   61    60 S   HA   _H6_    56     1.08460   115.79306  -179.86152
   62    60 S   NB   _N4_    57     1.35179   128.60999     0.21214
   63    57 S   CA   _C5_    58     1.40391   131.64800  -179.59895
   64    63 S   NND  _N8_    59     1.38134   122.20327     0.82044
   65    64 S   H    _H12    60     1.01063   120.23126     3.77595
   66    64 S   H    _H13    61     1.01048   119.01546   174.45716
  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   7   5   4   3
  10   5   4   2   1   1  12   6  12   7  10   6   5   5   9   4
   2   1   1   9   2   6   3   6   8   6   4   4   2   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    53  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    47    53    46  
   35    39    40    41    53  
   39    40    41    53  
   37    38  
   38  
    0  
   40    41    42    43    44    45    47    48    52    53    46    49  
   41    42    43    47    53    46  
   42    43    44    45    47    48    52    53    46    49    50    51  
   43    44    45    47    53    46    49  
   44    45    47    48    52    54    58    53    46    49  
   45    47    48    52    53    46  
   47    48    52    53    46  
   49    50    51    47    53  
   48    52    54    55    56    57    58    59    53  
   52    54    58    53  
   50    51  
   51  
    0  
   54    55    56    57    58    59    60    63    53  
   54    58  
   55    56    57    58    59    63  
   56    57    58  
   57    58    59    62    63    64  
   58    59    60    62    63    64    65    66  
   59    60    61    62    63    64  
   60    61    62    63  
   61    62    63    64  
   62    63  
   63    64    65    66  
   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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.9000   0.1400  -1.312500   1.7660   1.5600   0.020110767  -0.896042159
   47   3.5000   0.0660   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   49   3.7400   0.2000   0.937500   2.1070   1.8700   0.005000000   0.000000000
   50   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
   51   2.9800   0.2000  -0.912500   1.6890   1.4900   0.001000000  -0.126889456
   52   3.2500   0.1700  -0.500000   1.8000   1.6000   0.001000000  -0.511443539
   53   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   54   3.5000   0.0800   0.200000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   56   3.2500   0.1700  -0.490000   1.8000   1.6000   0.001000000  -0.511443539
   57   3.5000   0.0800   0.150000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.5000   0.0800   0.380000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.2500   0.1700  -0.550000   1.8000   1.6000   0.001000000  -0.511443539
   60   3.5000   0.0800   0.220000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   62   3.2500   0.1700  -0.530000   1.8000   1.6000   0.001000000  -0.511443539
   63   3.5000   0.0800   0.440000   2.0020   1.7750   0.001000000  -0.843144165
   64   3.2500   0.1700  -0.810000   1.8650   1.6500   0.051222218  -2.220205820
   65   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   66   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    53   320.000  1.410
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    46   320.000  1.410
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    47   250.000  1.527
   47    48   340.000  1.090
   47    52   275.000  1.479
   47    53   320.000  1.380
   52    54   440.000  1.371
   52    58   436.000  1.374
   54    55   367.000  1.080
   54    56   529.000  1.304
   56    57   414.000  1.391
   57    58   447.000  1.419
   57    63   469.000  1.404
   58    59   461.000  1.354
   59    60   502.000  1.324
   60    61   367.000  1.080
   60    62   502.000  1.324
   62    63   483.000  1.339
   63    64   481.000  1.340
   64    65   434.000  1.010
   64    66   434.000  1.010
   46    49   325.000  1.672
   49    50   325.000  1.672
   49    51   325.000  1.672
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    53    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    58.35000  112.70000
   39    41    46    50.00000  109.50000
   39    53    47    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    45    37.50000  110.70000
   41    43    47    75.00000  109.43000
   41    46    49   100.00000  120.50000
   43    41    42    37.50000  110.70000
   43    47    48    45.00000  112.01100
   43    47    52    75.00000  107.44000
   43    47    53    90.00000  108.56700
   45    43    44    33.00000  107.80000
   47    43    44    45.00000  108.72000
   47    43    45    45.00000  108.72000
   47    52    54    70.00000  128.80000
   47    52    58    70.00000  125.80000
   52    47    48    55.00000  103.44000
   52    54    55    35.00000  123.05000
   52    54    56    70.00000  113.90000
   52    58    57    70.00000  106.20000
   52    58    59    70.00000  126.20000
   54    56    57    70.00000  103.80000
   56    54    55    35.00000  123.05000
   56    57    58    70.00000  110.40000
   56    57    63    70.00000  132.40000
   57    58    59    70.00000  127.70000
   57    63    62    70.00000  117.30000
   57    63    64    70.00000  123.50000
   58    52    54    70.00000  105.40000
   58    59    60    70.00000  111.00000
   59    60    61    35.00000  115.45000
   59    60    62    70.00000  129.10000
   60    62    63    70.00000  118.60000
   62    60    61    35.00000  115.45000
   62    63    64    70.00000  119.30000
   63    57    58    85.00000  116.20000
   63    64    65    35.00000  120.00000
   63    64    66    35.00000  120.00000
   66    64    65    35.00000  120.00000
   53    39    40    35.00000  109.50000
   53    39    41    50.00000  109.50000
   53    47    48    35.00000  109.50000
   53    47    52   105.00000  106.22000
   46    41    42    35.00000  109.50000
   46    41    43    50.00000  109.50000
   46    49    50    45.00000  102.60000
   46    49    51    45.00000  102.60000
   51    49    50    35.00000   94.00000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    53   0.56750  1.0 1.0
   29    33    39    53  -0.07550 -1.0 2.0
   29    33    39    53   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.56750  1.0 1.0
   33    39    41    43  -0.07550 -1.0 2.0
   33    39    41    43   0.20000  1.0 3.0
   33    39    41    46   0.62750  1.0 1.0
   33    39    41    46  -0.30950 -1.0 2.0
   33    39    41    46   0.27300  1.0 3.0
   33    39    53    47   0.06250  1.0 1.0
   33    39    53    47  -0.01100 -1.0 2.0
   33    39    53    47   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    53   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    53   0.23400  1.0 3.0
   39    41    43    44   0.15000  1.0 3.0
   39    41    43    45   0.15000  1.0 3.0
   39    41   -43    47   3.97050  1.0 1.0
   39    41    46    49  -2.65550  1.0 1.0
   39    41    46    49  -0.22350 -1.0 2.0
   39    41    46    49   0.24150  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    46   0.23400  1.0 3.0
   40    39    53    47   0.37050  1.0 3.0
   41    39   -53    47   0.06250  1.0 1.0
   41    39   -53    47  -0.01100 -1.0 2.0
   41    39   -53    47   0.28050  1.0 3.0
   41    43    47    48   0.15000  1.0 3.0
   41    43    47    52  -0.64600  1.0 1.0
   41    43    47    52   0.58400 -1.0 2.0
   41    43   -47    53   0.62750  1.0 1.0
   41    43   -47    53  -0.30950 -1.0 2.0
   41    43   -47    53   0.27300  1.0 3.0
   41    46    49    50   0.05050  1.0 1.0
   41    46    49    50  -1.30700 -1.0 2.0
   41    46    49    50   0.91550  1.0 3.0
   41    46    49    51   0.05050  1.0 1.0
   41    46    49    51  -1.30700 -1.0 2.0
   41    46    49    51   0.91550  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    45   0.15000  1.0 3.0
   42    41    43    47   0.15000  1.0 3.0
   42    41    46    49   0.03000  1.0 3.0
   43    41    46    49  -2.65550  1.0 1.0
   43    41    46    49  -0.22350 -1.0 2.0
   43    41    46    49   0.24150  1.0 3.0
   43    47    52    54   1.10250  1.0 1.0
   43    47    52    54   0.01650 -1.0 2.0
   43    47    52    54   0.39100  1.0 3.0
   43    47    52    58   1.10250  1.0 1.0
   43    47    52    58   0.01650 -1.0 2.0
   43    47    52    58   0.39100  1.0 3.0
   43    47   -53    39   0.06250  1.0 1.0
   43    47   -53    39  -0.01100 -1.0 2.0
   43    47   -53    39   0.28050  1.0 3.0
   44    43    47    48   0.15000  1.0 3.0
   44    43    47    52   0.15000  1.0 3.0
   44    43    47    53   0.23400  1.0 3.0
   45    43    47    48   0.15000  1.0 3.0
   45    43    47    52   0.15000  1.0 3.0
   45    43    47    53   0.23400  1.0 3.0
   47    52    54    55   3.62500 -1.0 2.0
   47    52    54    56   3.62500 -1.0 2.0
   47    52    58    57   0.81400  1.0 1.0
   47    52    58    57   1.55550 -1.0 2.0
   47    52    58    59   3.62500 -1.0 2.0
   48    47    52    54   0.00000  1.0 1.0
   48    47    52    58   0.00000  1.0 1.0
   48    47    53    39   0.37050  1.0 3.0
   52    47    53    39  -2.37750  1.0 1.0
   52    47    53    39  -0.08150 -1.0 2.0
   52    47    53    39   0.59000  1.0 3.0
   52    54   -56    57   3.62500 -1.0 2.0
   52    58    59    60   3.62500 -1.0 2.0
   54    52   -58    57   0.70250  1.0 1.0
   54    52   -58    57   1.56150 -1.0 2.0
   54    52    58    59   3.62500 -1.0 2.0
   54    56   -57    58   3.62500 -1.0 2.0
   54    56    57    63   3.62500 -1.0 2.0
   55    54    56    57   3.62500 -1.0 2.0
   56    57   -58    52   3.62500 -1.0 2.0
   56    57    58    59   3.62500 -1.0 2.0
   56    57    63    62   3.62500 -1.0 2.0
   56    57    63    64   3.62500 -1.0 2.0
   57    58    59    60   3.62500 -1.0 2.0
   57    63    64    65   0.70000 -1.0 2.0
   57    63    64    66   0.70000 -1.0 2.0
   58    52    54    55   3.62500 -1.0 2.0
   58    52   -54    56   3.62500 -1.0 2.0
   58    57    63    62   3.62500 -1.0 2.0
   58    57    63    64   3.62500 -1.0 2.0
   58    59    60    61   3.62500 -1.0 2.0
   58    59   -60    62   3.62500 -1.0 2.0
   59    60    62    63   3.62500 -1.0 2.0
   60    62   -63    57   3.62500 -1.0 2.0
   60    62    63    64   3.62500 -1.0 2.0
   61    60    62    63   3.62500 -1.0 2.0
   62    63    64    65   0.70000 -1.0 2.0
   62    63    64    66   0.70000 -1.0 2.0
   63    57    58    52   3.00000 -1.0 2.0
   63    57   -58    59   3.62500 -1.0 2.0
   53    39    41    42   0.23400  1.0 3.0
   53    39   -41    43   0.62750  1.0 1.0
   53    39   -41    43  -0.30950 -1.0 2.0
   53    39   -41    43   0.27300  1.0 3.0
   53    39    41    46   1.11900  1.0 1.0
   53    39    41    46  -1.16350 -1.0 2.0
   53    39    41    46  -0.34150  1.0 3.0
   53    47    52    54   0.10350  1.0 1.0
   53    47    52    54  -0.15350 -1.0 2.0
   53    47    52    58   0.10350  1.0 1.0
   53    47    52    58  -0.15350 -1.0 2.0
   46    41    43    44   0.23400  1.0 3.0
   46    41    43    45   0.23400  1.0 3.0
   46    41    43    47   0.62750  1.0 1.0
   46    41    43    47  -0.30950 -1.0 2.0
   46    41    43    47   0.27300  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
   37    30    36    38  10.50000 -1.0 2.0
   54    58    52    47   4.00000 -1.0 2.0
   56    55    54    52   1.10000 -1.0 2.0
   58    63    57    56   4.00000 -1.0 2.0
   57    59    58    52   4.00000 -1.0 2.0
   62    61    60    59   1.10000 -1.0 2.0
   62    64    63    57   4.00000 -1.0 2.0
   66    63    64    65   1.00000 -1.0 2.0
END
