* LIGAND DATABASE FILE (OPLS2005)
*
001      64    63    113    158     325
    1     0 S   NP   _N1_     1    28.83545    95.33185   -21.35392
    2     1 S   H    _HN1     2     1.02945    80.39015    18.51374
    3     1 S   H    _H1_     3     1.02838    35.38335   157.45504
    4     1 S   H    _H2_     4     1.02790    95.46107   -89.18658
    5     1 S   CT   _CA1     5     1.50067   143.82361   130.24486
    6     5 S   HC   _HA1     6     1.09581   105.21315    75.77103
    7     5 S   CO3  _C1_     7     1.53702   112.39982   -44.43523
    8     7 S   O2Z  _O11     8     1.26366   115.08379   -46.24181
    9     7 S   O2Z  _O12     9     1.26198   114.87875   133.05165
   10     5 S   CT   _CB1    10     1.53078   107.45657  -166.36657
   11    10 S   HC   HB11    11     1.09828   109.27857   -50.84352
   12    10 S   HC   HB12    12     1.09812   110.52020    65.73949
   13    10 S   CT   _CG1    13     1.52975   112.59181  -171.87061
   14    13 S   HC   HG11    14     1.09559   110.55550   -66.11647
   15    13 S   HC   HG12    15     1.09669   109.84458    53.10595
   16    13 S   C    _CD1    16     1.51792   112.27866   173.48055
   17    16 S   O    _OE1    17     1.22717   123.30890     4.78381
   18    16 S   N    _N2_    18     1.38615   111.61515  -175.23096
   19    18 S   H    _HN2    19     1.01577   118.88720     1.21160
   20    18 S   CT1  _CA2    20     1.46322   123.43352   177.25576
   21    20 S   HC   _HA2    21     1.09722   109.46966    -2.57375
   22    20 S   C    _C2_    22     1.53497   108.41612  -118.13256
   23    22 S   O    _O2_    23     1.23038   122.29187  -149.42363
   24    20 S   CT   _CB2    32     1.53310   111.31668   119.70440
   25    24 S   HC   HB21    33     1.09379   109.29780    55.71554
   26    24 S   HC   HB22    34     1.09502   110.78840   174.28831
   27    22 S   N    _N3_    24     1.38313   113.61664    37.88113
   28    27 S   H    _HN3    25     1.01609   119.49317    -3.07988
   29    24 S   S    _SG2    35     1.82748   111.27128   -66.24038
   30    27 S   CT   _CA3    26     1.45278   123.29816   177.38267
   31    30 S   HC   HA31    27     1.09544   107.46598   -66.31061
   32    30 S   HC   HA32    28     1.09555   108.06405    50.17285
   33    29 S   CT   _C9_    36     1.82832   100.09798   161.60541
   34    33 S   HC   _H15    37     1.09575   107.09963   167.26454
   35    33 S   HC   _H16    38     1.09498   108.94810    51.77638
   36    30 S   CO3  _C3_    29     1.52966   113.99820   172.20328
   37    36 S   O2Z  _O31    30     1.26381   116.03422    -0.54715
   38    36 S   O2Z  _O32    31     1.26419   114.42638   179.52071
   39    33 S   CT   _C8_    39     1.53094   113.63906   -71.69924
   40    39 S   HC   _H13    40     1.09567   108.79208  -176.60944
   41    39 S   HC   _H14    41     1.09424   110.23163    66.74413
   42    39 S   NX   _N5_    42     1.46184   112.22292   -56.13168
   43    42 S   H    _H12    43     1.01916   108.70005    36.76485
   44    42 S   P1   _P1_    44     1.65892   119.05163   170.75752
   45    44 S   O2Z  _O34    45     1.50893   114.27149    46.01962
   46    44 S   NX   _N4_    46     1.66185   105.13945   -80.14392
   47    46 S   H    _H7_    47     1.01856   114.12044    54.57784
   48    44 S   OS   _O33    55     1.62759   105.79569   166.88030
   49    46 S   CT   _C6_    48     1.46260   118.78000  -175.42500
   50    49 S   HC   _H8_    49     1.09577   109.23713   -64.50050
   51    49 S   HC   _H9_    50     1.09459   109.63902    53.34512
   52    48 S   CT   _C5_    56     1.42282   120.97577    58.83504
   53    52 S   HC   _H5_    57     1.09299   109.66364    59.06031
   54    52 S   HC   _H6_    58     1.09394   108.89923   -59.82620
   55    49 S   CT   _C7_    51     1.52276   110.06400   174.23048
   56    55 S   Cl   Cl1_    52     1.77910   110.39496   179.91607
   57    55 S   HC   _H10    53     1.09467   111.37832    60.59766
   58    55 S   HC   _H11    54     1.09404   111.38109   -60.57694
   59    52 S   CT   _C4_    59     1.51947   109.14923  -178.95022
   60    59 S   HC   _H3_    60     1.09500   110.97835    47.68429
   61    59 S   HC   _H4_    61     1.09479   109.60591   167.80969
   62    59 S   CO4  _C10    62     1.51088   113.15877   -72.97959
   63    62 S   O    _O35    63     1.22602   125.06733     8.89353
   64    62 S   HC   _H17    64     1.10374   114.72548  -172.82370
  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
   8   5   4   2   1   1   8   4   3   8   4  12   5  10   5   8
   6   5   4   8   5   4   3   2   1   1   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    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    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44  
   35    39    40    41    42  
   39    40    41    42  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    48  
   41    42    43    44  
   42    43    44  
   43    44    45    46    47    49    48    52  
   44    45    46    48  
   45    46    47    49    50    51    55    48    52    53    54    59  
   46    47    49    48    52  
   47    49    50    51    55    56    57    58    48    52  
   49    50    51    55    48  
   52    53    54    59    60    61    62    49  
   50    51    55    56    57    58  
   51    55    56    57    58  
   55    56    57    58  
   53    54    59    60    61    62    63    64  
   54    59    60    61    62  
   59    60    61    62  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62    63    64  
   61    62    63    64  
   62    63    64  
   63    64  
   64  
    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  -0.060200   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.2500   0.1700  -0.566600   1.8100   1.6000   0.054801302  -1.445846770
   43   0.5000   0.0300   0.294300   0.9960   0.8600   0.030040813  -0.651083722
   44   3.7400   0.2000   1.279300   2.1070   1.8700   0.005000000   0.000000000
   45   2.9800   0.2000  -0.666100   1.6890   1.4900   0.001000000  -0.126889456
   46   3.2500   0.1700  -0.566600   1.8100   1.6000   0.054801302  -1.445846770
   47   0.5000   0.0300   0.294300   0.9960   0.8600   0.030040813  -0.651083722
   48   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   49   3.5000   0.0660  -0.060200   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.152900   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.006000   1.9750   1.7500   0.005000000  -0.741685710
   56   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   57   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   64   2.4200   0.0150   0.000000   1.3810   1.2100   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    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   340.000  1.090
   39    42   310.000  1.452
   42    43   505.000  1.018
   42    44   305.000  1.702
   44    45   675.000  1.490
   44    46   305.000  1.702
   44    48   405.000  1.623
   46    47   505.000  1.018
   46    49   310.000  1.452
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    55   268.000  1.529
   55    56   245.000  1.781
   55    57   340.000  1.090
   55    58   340.000  1.090
   48    52   320.000  1.410
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   317.000  1.522
   62    63   570.000  1.229
   62    64   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    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    37.50000  110.70000
   33    39    42    75.00000  110.98300
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    42    43    50.00000  108.89700
   39    42    44    60.00000  116.07500
   41    39    40    33.00000  107.80000
   42    39    40    50.00000  110.67200
   42    39    41    50.00000  110.67200
   42    44    45    85.00000  116.90400
   42    44    46    90.00000  104.15300
   42    44    48   105.00000  102.60700
   44    42    43    40.00000  115.80200
   44    46    47    40.00000  115.80200
   44    46    49    60.00000  116.07500
   44    48    52    75.00000  119.24600
   46    44    45    85.00000  116.90400
   46    49    50    50.00000  110.67200
   46    49    51    50.00000  110.67200
   46    49    55    75.00000  110.98300
   49    46    47    50.00000  108.89700
   49    55    56    69.00000  109.80000
   49    55    57    37.50000  110.70000
   49    55    58    37.50000  110.70000
   51    49    50    33.00000  107.80000
   55    49    50    37.50000  110.70000
   55    49    51    37.50000  110.70000
   57    55    56    51.00000  107.60000
   58    55    56    51.00000  107.60000
   58    55    57    33.00000  107.80000
   48    44    45   100.00000  115.86100
   48    44    46   105.00000  102.60700
   48    52    53    35.00000  109.50000
   48    52    54    35.00000  109.50000
   48    52    59    50.00000  109.50000
   52    59    60    37.50000  110.70000
   52    59    61    37.50000  110.70000
   52    59    62    63.00000  111.10000
   54    52    53    33.00000  107.80000
   59    52    53    37.50000  110.70000
   59    52    54    37.50000  110.70000
   59    62    63    80.00000  120.40000
   59    62    64    35.00000  115.00000
   61    59    60    33.00000  107.80000
   62    59    60    35.00000  109.50000
   62    59    61    35.00000  109.50000
   64    62    63    35.00000  123.00000
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   0.15000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   33    39    42    43   0.14900  1.0 1.0
   33    39    42    43  -0.14450 -1.0 2.0
   33    39    42    43  -0.19400  1.0 3.0
   33    39    42    44  -2.23400  1.0 1.0
   33    39    42    44  -0.50500 -1.0 2.0
   33    39    42    44   0.66300  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    42   0.15000  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    42   0.15000  1.0 3.0
   39    42    44    45   0.00000  1.0 1.0
   39    42    44    46   0.50000  1.0 3.0
   39    42    44    48   0.29300  1.0 1.0
   39    42    44    48  -1.33650 -1.0 2.0
   39    42    44    48   0.62200  1.0 3.0
   40    39    42    43   0.20000  1.0 3.0
   40    39    42    44   0.05900  1.0 3.0
   41    39    42    43   0.20000  1.0 3.0
   41    39    42    44   0.05900  1.0 3.0
   42    44    46    47   0.50000  1.0 3.0
   42    44    46    49   0.50000  1.0 3.0
   42    44    48    52  -0.14600  1.0 1.0
   42    44    48    52  -0.87400 -1.0 2.0
   42    44    48    52   0.68500  1.0 3.0
   43    42    44    45   0.00000  1.0 1.0
   43    42    44    46   0.50000  1.0 3.0
   43    42    44    48   0.07350  1.0 1.0
   43    42    44    48  -1.26400 -1.0 2.0
   43    42    44    48   0.45050  1.0 3.0
   44    46    49    50   0.05900  1.0 3.0
   44    46    49    51   0.05900  1.0 3.0
   44    46    49    55  -2.23400  1.0 1.0
   44    46    49    55  -0.50500 -1.0 2.0
   44    46    49    55   0.66300  1.0 3.0
   44    48    52    53   0.03000  1.0 3.0
   44    48    52    54   0.03000  1.0 3.0
   44    48    52    59  -2.65550  1.0 1.0
   44    48    52    59  -0.22350 -1.0 2.0
   44    48    52    59   0.24150  1.0 3.0
   45    44    46    47   0.00000  1.0 1.0
   45    44    46    49   0.00000  1.0 1.0
   45    44    48    52   0.00000  1.0 1.0
   46    44    48    52  -0.14600  1.0 1.0
   46    44    48    52  -0.87400 -1.0 2.0
   46    44    48    52   0.68500  1.0 3.0
   46    49    55    56   0.56750  1.0 1.0
   46    49    55    56  -0.07550 -1.0 2.0
   46    49    55    56   0.20000  1.0 3.0
   46    49    55    57   0.15000  1.0 3.0
   46    49    55    58   0.15000  1.0 3.0
   47    46    49    50   0.20000  1.0 3.0
   47    46    49    51   0.20000  1.0 3.0
   47    46    49    55   0.14900  1.0 1.0
   47    46    49    55  -0.14450 -1.0 2.0
   47    46    49    55  -0.19400  1.0 3.0
   50    49    55    56   0.27000  1.0 3.0
   50    49    55    57   0.15000  1.0 3.0
   50    49    55    58   0.15000  1.0 3.0
   51    49    55    56   0.27000  1.0 3.0
   51    49    55    57   0.15000  1.0 3.0
   51    49    55    58   0.15000  1.0 3.0
   48    44    46    47   0.07350  1.0 1.0
   48    44    46    47  -1.26400 -1.0 2.0
   48    44    46    47   0.45050  1.0 3.0
   48    44    46    49   0.29300  1.0 1.0
   48    44    46    49  -1.33650 -1.0 2.0
   48    44    46    49   0.62200  1.0 3.0
   48    52    59    60   0.23400  1.0 3.0
   48    52    59    61   0.23400  1.0 3.0
   48    52    59    62  -0.09450  1.0 1.0
   48    52    59    62  -1.12950 -1.0 2.0
   48    52    59    62   0.54000  1.0 3.0
   52    59    62    63   0.30150 -1.0 2.0
   52    59    62    64   0.74550  1.0 1.0
   52    59    62    64  -0.00500 -1.0 2.0
   53    52    59    60   0.15000  1.0 3.0
   53    52    59    61   0.15000  1.0 3.0
   53    52    59    62  -0.11250  1.0 3.0
   54    52    59    60   0.15000  1.0 3.0
   54    52    59    61   0.15000  1.0 3.0
   54    52    59    62  -0.11250  1.0 3.0
   60    59    62    63   0.00000  1.0 1.0
   60    59    62    64   0.00000  1.0 1.0
   61    59    62    63   0.00000  1.0 1.0
   61    59    62    64   0.00000  1.0 1.0
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
   43    44    42    39   1.00000 -1.0 2.0
   47    44    46    49   1.00000 -1.0 2.0
   59    64    62    63  10.50000 -1.0 2.0
END
