* LIGAND DATABASE FILE (OPLS2005)
*
001      65    65    115    168     334
    1     0 S   NP   _N1_     1    30.88503    98.79390   -19.57771
    2     1 S   H    _HN1     2     1.02780    28.28313   145.52503
    3     1 S   H    _H1_     3     1.03735   127.49380    94.85315
    4     1 S   H    _H2_     4     1.02971   112.90097  -127.98507
    5     1 S   CT   _CA1     5     1.50597    83.81180   -16.39022
    6     5 S   HC   _HA1     6     1.09648   104.39391    83.23651
    7     5 S   CO3  _C1_     7     1.54325   112.20736   -32.40955
    8     7 S   O2Z  _O11     8     1.26099   116.66023  -141.88761
    9     7 S   O2Z  _O12     9     1.26659   114.16479    38.62412
   10     5 S   CT   _CB1    10     1.52811   106.34802  -160.05983
   11    10 S   HC   HB11    11     1.09523   109.35597   -30.68162
   12    10 S   HC   HB12    12     1.09807   110.38526    84.96761
   13    10 S   CT   _CG1    13     1.53024   113.51820  -151.85612
   14    13 S   HC   HG11    14     1.09434   111.65208   -65.16481
   15    13 S   HC   HG12    15     1.09640   110.78454    54.66874
   16    13 S   C    _CD1    16     1.51539   109.21395   174.68286
   17    16 S   O    _OE1    17     1.22816   122.03403   102.80811
   18    16 S   N    _N2_    18     1.38338   112.48048   -74.89978
   19    18 S   H    _HN2    19     1.02106   118.83307    -2.03317
   20    18 S   CT1  _CA2    20     1.45834   123.30464   169.20840
   21    20 S   HC   _HA2    21     1.09697   108.86620    26.68466
   22    20 S   C    _C2_    22     1.53311   107.89404   -89.34791
   23    22 S   O    _O2_    23     1.23148   120.79889   146.24179
   24    20 S   CT   _CB2    32     1.53086   111.82792   150.13234
   25    24 S   HC   HB21    33     1.09536   110.28707    54.99525
   26    24 S   HC   HB22    34     1.09526   110.41022   174.13562
   27    22 S   N    _N3_    24     1.38504   114.59733   -40.71521
   28    27 S   H    _HN3    25     1.01931   119.17543     1.57097
   29    24 S   S    _SG2    35     1.82405   110.72125   -65.71003
   30    27 S   CT   _CA3    26     1.45372   123.69255   178.52302
   31    30 S   HC   HA31    27     1.09524   109.32246    28.10025
   32    30 S   HC   HA32    28     1.09514   107.20998   144.90835
   33    29 S   CT   _C13    36     1.82051    99.40380   168.71982
   34    33 S   HC   _H10    37     1.09475   110.41835   -19.32567
   35    33 S   HC   _H11    38     1.09433   108.76568    98.35137
   36    30 S   CO3  _C3_    29     1.53047   112.62992   -95.06971
   37    36 S   O2Z  _O31    30     1.26484   115.43407   -68.53508
   38    36 S   O2Z  _O32    31     1.26380   115.12054   112.33444
   39    33 S   CM   _C11    39     1.49495   109.33884  -139.95160
   40    39 S   CMA  _C12    40     1.52279   121.04148  -101.31639
   41    40 S   OM   _O41    41     1.26309   121.19009  -120.36106
   42    40 S   OM   _O42    42     1.26313   120.42342    59.29003
   43    39 S   OS   _O40    43     1.38437   115.91238   102.04151
   44    43 S   CT   _C5_    44     1.43655   111.55146  -122.01162
   45    44 S   HC   _H3_    45     1.09957   111.38852   -15.09343
   46    44 S   CT   _C4_    46     1.54350   108.62399  -132.72364
   47    46 S   HC   _H6_    47     1.09736   108.73101   158.55340
   48    46 S   HC   _H7_    48     1.09655   109.21581    41.40094
   49    46 S   CM   _C9_    49     1.51059   114.43722   -80.91287
   50    49 S   CM   _C8_    50     1.34341   122.77075   -10.62781
   51    50 S   HC   _H8_    51     1.08705   120.52882   178.43815
   52    49 S   CO3  _C10    63     1.54420   117.92204   169.08532
   53    52 S   O2Z  _O34    64     1.26481   116.21079  -146.96233
   54    52 S   O2Z  _O33    65     1.26601   114.98588    32.75633
   55    50 S   CT   _C7_    52     1.50347   123.06781    -0.61929
   56    55 S   HC   _H5_    53     1.09714   107.03930   102.51256
   57    44 S   CT   _C6_    54     1.53762   109.35952   106.18545
   58    57 S   HC   _H4_    55     1.09444   110.98349   -58.25623
   59    55 S   OS   _O35    58     1.42730   108.74155  -139.50362
   60    57 S   OH   _O39    56     1.43180   109.30939  -175.61175
   61    60 S   HO   _H9_    57     0.97207   107.11945    60.86662
   62    59 S   P3   _P1_    59     1.64790   119.04032  -129.26968
   63    62 S   O2Z  _O37    60     1.52541   103.77064  -177.78654
   64    62 S   O2Z  _O38    61     1.52431   104.73491    62.37982
   65    62 S   O2Z  _O36    62     1.52414   104.58501   -58.30112
  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   6   5   4   3
   8   4   3   2   1   1   8   4   2   1  10  14   8  12   5   4
   9  11   5   3   1   1  10   5   5   3   5   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    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    43  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44  
   35    39    40    43  
   39    40    43  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    57  
   41    42    43    44  
   42    43  
   43  
   44    45    46    47    48    49    55    57    58    60  
   45    46    47    48    49    50    55    56    57    58    60    61    59    52  
   46    47    48    49    55    57    58    60  
   47    48    49    50    51    55    57    58    60    52    53    54  
   48    49    50    57    52  
   49    50    57    52  
   50    51    55    56    57    59    52    53    54  
   51    55    56    57    58    60    59    62    52    53    54  
   55    56    57    59    52  
   53    54    55  
   54  
    0  
   56    57    58    60    61    59    62    63    64    65  
   57    58    60    59    62  
   58    60    61    59    62  
   60    61    59  
   62    63    64    65    60  
   61  
    0  
   63    64    65  
   64    65  
   65  
    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   3.5500   0.0760  -0.516200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.149000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   42   3.1500   0.2500  -0.773900   1.7000   1.5000   0.001000000  -0.126889456
   43   2.8500   0.1400  -0.285000   1.5900   1.4000   0.020110767  -0.896042159
   44   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760  -0.310300   2.0020   1.7750   0.023028004  -0.852763146
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   55   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.8500   0.1400  -0.760000   1.5900   1.4000   0.020110767  -0.896042159
   60   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   62   3.7400   0.2000   1.919900   2.1070   1.8700   0.005000000   0.000000000
   63   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   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
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   317.000  1.510
   39    40   465.000  1.376
   39    43   440.000  1.360
   40    41   745.000  1.250
   40    42   745.000  1.250
   43    44   320.000  1.410
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    57   268.000  1.529
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   317.000  1.510
   49    50   549.000  1.340
   49    52   230.000  1.545
   50    51   340.000  1.080
   50    55   317.000  1.510
   55    56   340.000  1.090
   55    57   268.000  1.529
   55    59   320.000  1.410
   57    58   340.000  1.090
   57    60   320.000  1.410
   60    61   553.000  0.945
   59    62   230.000  1.630
   62    63   525.000  1.516
   62    64   525.000  1.516
   62    65   525.000  1.516
   52    53   656.000  1.250
   52    54   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    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  112.20000
   33    39    40    70.00000  124.00000
   33    39    43    85.00000  112.85300
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    42    65.00000  137.10300
   39    43    44    90.00000  111.18400
   42    40    41    65.00000  121.00000
   43    39    40    80.00000  120.01400
   43    44    45    35.00000  109.50000
   43    44    46    50.00000  109.50000
   43    44    57    50.00000  109.50000
   44    46    47    37.50000  110.70000
   44    46    48    37.50000  110.70000
   44    46    49    70.00000  112.02700
   44    57    55    58.35000  112.70000
   44    57    58    37.50000  110.70000
   44    57    60    50.00000  109.50000
   46    44    45    37.50000  110.70000
   46    49    50    70.00000  124.00000
   46    49    52    65.00000  117.04000
   48    46    47    33.00000  107.80000
   49    46    47    35.00000  109.50000
   49    46    48    35.00000  109.50000
   49    50    51    35.00000  120.00000
   49    50    55    70.00000  124.00000
   49    52    53    85.00000  113.83300
   49    52    54    85.00000  113.83300
   50    55    56    35.00000  109.50000
   50    55    57    70.00000  112.02700
   50    55    59    85.00000  110.90400
   55    50    51    35.00000  117.00000
   55    57    58    37.50000  110.70000
   55    57    60    50.00000  109.50000
   55    59    62    80.00000  112.68000
   57    44    45    37.50000  110.70000
   57    44    46    58.35000  112.70000
   57    55    56    37.50000  110.70000
   57    60    61    55.00000  108.50000
   60    57    58    35.00000  109.50000
   59    55    56    35.00000  109.50000
   59    55    57    50.00000  109.50000
   59    62    63   100.00000  107.00000
   59    62    64   100.00000  107.00000
   59    62    65   100.00000  107.00000
   64    62    63   140.00000  114.00000
   65    62    63   140.00000  114.00000
   65    62    64   140.00000  114.00000
   52    49    50    55.00000  124.75400
   54    52    53    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    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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    43   0.09700  1.0 1.0
   29    33    39    43   0.15600 -1.0 2.0
   29    33    39    43  -0.50800  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    42   7.00000 -1.0 2.0
   33    39    43    44   2.00000 -1.0 2.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    43   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    43   0.00000  1.0 1.0
   39    43    44    45   0.08050  1.0 3.0
   39    43    44    46  -0.46850  1.0 1.0
   39    43    44    46   0.09300 -1.0 2.0
   39    43    44    46  -0.12850  1.0 3.0
   39    43    44    57  -0.46850  1.0 1.0
   39    43    44    57   0.09300 -1.0 2.0
   39    43    44    57  -0.12850  1.0 3.0
   40    39    43    44  -2.26850  1.0 1.0
   40    39    43    44   3.39050 -1.0 2.0
   43    39    40    41   7.00000 -1.0 2.0
   43    39    40    42   7.00000 -1.0 2.0
   43    44    46    47   0.23400  1.0 3.0
   43    44    46    48   0.23400  1.0 3.0
   43    44    46    49   0.61850  1.0 1.0
   43    44    46    49  -0.22750 -1.0 2.0
   43    44    46    49   0.15300  1.0 3.0
   43    44    57    55   0.62750  1.0 1.0
   43    44    57    55  -0.30950 -1.0 2.0
   43    44    57    55   0.27300  1.0 3.0
   43    44    57    58   0.23400  1.0 3.0
   43    44    57    60   3.69350  1.0 1.0
   43    44    57    60  -1.82950 -1.0 2.0
   44    46    49    50   0.09850  1.0 1.0
   44    46    49    50   0.15250 -1.0 2.0
   44    46    49    50  -0.50650  1.0 3.0
   44    46    49    52   0.09700  1.0 1.0
   44    46    49    52   0.15600 -1.0 2.0
   44    46    49    52  -0.50800  1.0 3.0
   44    57    60    61  -0.11600  1.0 1.0
   44    57    60    61  -0.09450 -1.0 2.0
   44    57    60    61   0.21250  1.0 3.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    48   0.15000  1.0 3.0
   45    44    46    49   0.15000  1.0 3.0
   45    44    57    55   0.15000  1.0 3.0
   45    44    57    58   0.15000  1.0 3.0
   45    44    57    60   0.23400  1.0 3.0
   46    44    57    55   0.56750  1.0 1.0
   46    44    57    55  -0.07550 -1.0 2.0
   46    44    57    55   0.20000  1.0 3.0
   46    44    57    58   0.15000  1.0 3.0
   46    44    57    60   0.86500  1.0 1.0
   46    44    57    60  -0.17500 -1.0 2.0
   46    44    57    60   0.20800  1.0 3.0
   46    49    50    51   7.00000 -1.0 2.0
   46    49   -50    55   7.00000 -1.0 2.0
   46    49    52    53  -0.64400  1.0 1.0
   46    49    52    53   0.26850 -1.0 2.0
   46    49    52    54  -0.64400  1.0 1.0
   46    49    52    54   0.26850 -1.0 2.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    52   0.15000  1.0 3.0
   48    46    49    50   0.00000  1.0 1.0
   48    46    49    52   0.15000  1.0 3.0
   49    50    55    56   0.00000  1.0 1.0
   49    50    55    57   0.09850  1.0 1.0
   49    50    55    57   0.15250 -1.0 2.0
   49    50    55    57  -0.50650  1.0 3.0
   49    50    55    59   0.39000  1.0 1.0
   49    50    55    59  -0.05800 -1.0 2.0
   49    50    55    59  -0.55150  1.0 3.0
   50    49    52    53  -0.04000 -1.0 2.0
   50    49    52    53  -0.29050  1.0 3.0
   50    49    52    54  -0.04000 -1.0 2.0
   50    49    52    54  -0.29050  1.0 3.0
   50    55   -57    44   0.34400  1.0 1.0
   50    55   -57    44   0.09450 -1.0 2.0
   50    55   -57    44   0.11100  1.0 3.0
   50    55    57    58   0.15000  1.0 3.0
   50    55    57    60   1.05650  1.0 1.0
   50    55    57    60   0.15600 -1.0 2.0
   50    55    57    60   0.53150  1.0 3.0
   50    55    59    62   0.37500  1.0 3.0
   51    50    55    56   0.33100  1.0 3.0
   51    50    55    57   0.00000  1.0 1.0
   51    50    55    59   0.00000  1.0 1.0
   55    57    60    61  -0.11600  1.0 1.0
   55    57    60    61  -0.09450 -1.0 2.0
   55    57    60    61   0.21250  1.0 3.0
   55    59    62    63   0.00000  1.0 1.0
   55    59    62    64   0.00000  1.0 1.0
   55    59    62    65   0.00000  1.0 1.0
   56    55    57    44   0.15000  1.0 3.0
   56    55    57    58   0.15000  1.0 3.0
   56    55    57    60   0.23400  1.0 3.0
   56    55    59    62   0.03000  1.0 3.0
   57    44    46    47   0.15000  1.0 3.0
   57    44    46    48   0.15000  1.0 3.0
   57    44   -46    49   0.34400  1.0 1.0
   57    44   -46    49   0.09450 -1.0 2.0
   57    44   -46    49   0.11100  1.0 3.0
   57    55    59    62  -2.65550  1.0 1.0
   57    55    59    62  -0.22350 -1.0 2.0
   57    55    59    62   0.24150  1.0 3.0
   58    57    60    61   0.19450  1.0 3.0
   59    55    57    44   0.62750  1.0 1.0
   59    55    57    44  -0.30950 -1.0 2.0
   59    55    57    44   0.27300  1.0 3.0
   59    55    57    58   0.23400  1.0 3.0
   59    55    57    60   3.69350  1.0 1.0
   59    55    57    60  -1.82950 -1.0 2.0
   52    49    50    51   7.00000 -1.0 2.0
   52    49    50    55   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   33    43    39    40  15.00000 -1.0 2.0
   41    42    40    39  15.00000 -1.0 2.0
   46    52    49    50   1.10000 -1.0 2.0
   55    51    50    49   1.10000 -1.0 2.0
   53    49    52    54  10.50000 -1.0 2.0
END
