* LIGAND DATABASE FILE (OPLS2005)
*
001      68    72    127    215     375
    1     0 S   NP   _N1_     1    29.23084    97.39255   -19.95988
    2     1 S   H    _HN1     2     1.02946    69.61164    21.60946
    3     1 S   H    _H1_     3     1.02833    51.90505   155.16448
    4     1 S   H    _H2_     4     1.02792    86.98833   -89.27567
    5     1 S   CT   _CA1     5     1.50142   158.69198   115.78014
    6     5 S   HC   _HA1     6     1.09562   105.18022    91.59499
    7     5 S   CO3  _C1_     7     1.53789   112.41058   -28.72970
    8     7 S   O2Z  _O11     8     1.26390   114.96689   -41.39821
    9     7 S   O2Z  _O12     9     1.26210   114.96329   137.61219
   10     5 S   CT   _CB1    10     1.53052   107.43495  -150.25401
   11    10 S   HC   HB11    11     1.09835   109.46850   -47.27760
   12    10 S   HC   HB12    12     1.09816   110.43766    69.37967
   13    10 S   CT   _CG1    13     1.53021   112.62992  -168.14316
   14    13 S   HC   HG11    14     1.09509   110.76692   -64.01513
   15    13 S   HC   HG12    15     1.09673   109.75150    55.10520
   16    13 S   C    _CD1    16     1.51852   112.02216   175.26368
   17    16 S   O    _OE1    17     1.22747   123.19679     5.18969
   18    16 S   N    _N2_    18     1.38638   111.81227  -174.43296
   19    18 S   H    _HN2    19     1.01604   118.98105     0.25717
   20    18 S   CT1  _CA2    20     1.46100   123.30294   175.00790
   21    20 S   HC   _HA2    21     1.09741   109.27563     3.42526
   22    20 S   C    _C2_    22     1.53699   108.46070  -111.65577
   23    22 S   O    _O2_    23     1.23065   122.33705  -148.78099
   24    20 S   CT   _CB2    32     1.53282   112.18217   125.62965
   25    24 S   HC   HB21    33     1.09504   110.90843    56.99776
   26    24 S   HC   HB22    34     1.09557   109.80092   174.67715
   27    22 S   N    _N3_    24     1.38348   113.75319    38.76649
   28    27 S   H    _HN3    25     1.01563   119.56466    -3.39263
   29    24 S   S    _SG2    35     1.82895   112.42039   -67.51084
   30    27 S   CT   _CA3    26     1.45277   123.27738   177.16275
   31    30 S   HC   HA31    27     1.09547   107.52721   -64.57936
   32    30 S   HC   HA32    28     1.09556   107.98396    51.88053
   33    29 S   CT   _C22    36     1.86513   100.08141   100.81337
   34    33 S   HC   _H3_    37     1.09854   106.34823   -42.91966
   35    30 S   CO3  _C3_    29     1.52969   114.02943   173.88166
   36    35 S   O2Z  _O31    30     1.26384   116.06020     0.00000
   37    35 S   O2Z  _O32    31     1.26420   114.42293  -179.93439
   38    33 S   CA   _C19    38     1.52737   107.64978  -158.68840
   39    38 S   CA   _C11    39     1.40053   118.86238    82.95002
   40    39 S   HA   _H30    40     1.08760   119.08378     1.38607
   41    38 S   CA   _C18    61     1.41216   121.28299   -95.12148
   42    39 S   CA   _C14    41     1.39545   121.24228  -178.16400
   43    41 S   CM   _C20    62     1.47641   117.58282    -1.87304
   44    43 S   HC   _H31    63     1.08226   119.78692   166.43173
   45    42 S   CA   _C9_    42     1.40070   120.24143  -180.00000
   46    45 S   HA   _H28    43     1.08831   120.57125     0.12972
   47    42 S   CR3  _C17    59     1.41359   119.68595     0.06561
   48    43 S   CM   _C21    64     1.34186   121.72362   -15.39340
   49    48 S   HC   _H32    65     1.08827   118.58244  -178.30985
   50    45 S   CA   _C7_    44     1.39317   120.87313   179.98022
   51    50 S   HA   _H26    45     1.08792   118.71696  -179.82529
   52    56 S   CR3  _C16    60     1.41673   119.33051    -0.03426
   53    33 S   CT   _C23    66     1.56625   110.50454    76.53784
   54    53 S   OM   _O21    67     1.32513   108.87221  -157.36859
   55    53 S   HC   _H34    68     1.09945   107.36764   -28.75501
   56    50 S   CA   _C12    46     1.39786   120.50964     0.03426
   57    56 S   CA   _C5_    47     1.40262   120.94596  -179.97202
   58    57 S   HA   _H24    48     1.08799   120.59939    -0.05595
   59    57 S   CA   _C4_    49     1.39258   120.58594   179.91607
   60    59 S   HA   _H23    50     1.08626   119.99189  -179.98022
   61    59 S   CA   _C6_    51     1.39255   120.00395    -0.04846
   62    61 S   HA   _H25    52     1.08796   118.82282  -179.91153
   63    61 S   CA   _C13    53     1.40303   120.57451     0.03426
   64    63 S   CA   _C8_    54     1.39466   121.14932  -179.80923
   65    64 S   HA   _H27    55     1.08810   120.67335     0.12820
   66    64 S   CA   _C10    56     1.39747   120.67799   179.97202
   67    66 S   HA   _H29    57     1.08666   116.48402  -179.47400
   68    66 S   CA   _C15    58     1.41447   122.29532     0.22468
  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   9   5   4   3
  13   7   2   1   1  14  11   4  12  10   9   4   8   4  10   5
   3   7   3  11   2   1   1   8   6   3   5   3   5   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    53    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    48    53    54    55  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    42    68    41    43    48    49    53    54    55  
   38    39    41    48    53    54    55  
   36    37  
   37  
    0  
   39    40    42    45    66    68    47    41    43    44    48    53    54    55  
   40    42    45    46    50    68    47    52    41    43    53  
   42    45    47    41  
   43    44    48    49    53    42    47    52    64    66    67    68  
   45    46    50    51    56    63    66    68    47    52  
   44    48    49    53    54    55    47    66    68  
   48    49    53    68  
   46    50    51    56    57    68    47    52  
   50    51    56    47  
   52    50    56    57    61    63    64    66    67    68  
   49    53    54    55    68  
   53    54    55  
   51    56    57    58    59    63    52  
   56    57    52  
   56    57    58    59    61    62    63    64    65    66    68  
   54    55  
   55  
    0  
   57    58    59    60    61    63    64    68  
   58    59    60    61    62    63  
   59    60    61  
   60    61    62    63    64  
   61    62    63  
   62    63    64    65    66  
   63    64  
   64    65    66    67    68  
   65    66    67    68  
   66    67    68  
   67    68  
   68  
    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   0.222500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   40   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   41   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   51   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   52   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   53   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   54   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   55   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
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   317.000  1.510
   33    53   268.000  1.529
   38    39   469.000  1.400
   38    41   469.000  1.400
   39    40   367.000  1.080
   39    42   469.000  1.400
   42    45   469.000  1.400
   42    47   490.000  1.398
   45    46   367.000  1.080
   45    50   469.000  1.400
   50    51   367.000  1.080
   50    56   469.000  1.400
   56    57   469.000  1.400
   56    52   490.000  1.398
   57    58   367.000  1.080
   57    59   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   367.000  1.080
   61    63   469.000  1.400
   63    64   469.000  1.400
   63    52   490.000  1.398
   64    65   367.000  1.080
   64    66   469.000  1.400
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    47   490.000  1.398
   68    41   469.000  1.400
   47    52   490.000  1.398
   41    43   320.000  1.460
   43    44   340.000  1.080
   43    48   549.000  1.340
   48    49   340.000  1.080
   48    53   317.000  1.510
   53    54   570.000  1.307
   53    55   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    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    80.00000  109.48900
   29    33    53    75.00000  111.63000
   33    38    39    70.00000  120.00000
   33    38    41    70.00000  120.00000
   33    53    48    70.00000  112.02700
   33    53    54    50.00000  109.50000
   33    53    55    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  120.00000
   38    39    42    63.00000  120.00000
   38    41    68    63.00000  120.00000
   38    41    43    60.00000  120.93500
   39    42    45    63.00000  120.00000
   39    42    47    70.00000  112.88000
   42    39    40    35.00000  120.00000
   42    45    46    35.00000  120.00000
   42    45    50    63.00000  120.00000
   42    47    68    60.00000  130.80000
   42    47    52    60.00000  130.80000
   45    50    51    35.00000  120.00000
   45    50    56    63.00000  120.00000
   50    45    46    35.00000  120.00000
   50    56    57    63.00000  120.00000
   50    56    52    70.00000  112.88000
   56    50    51    35.00000  120.00000
   56    57    58    35.00000  120.00000
   56    57    59    63.00000  120.00000
   56    52    63    60.00000  130.80000
   56    52    47    60.00000  130.80000
   57    59    60    35.00000  120.00000
   57    59    61    63.00000  120.00000
   59    57    58    35.00000  120.00000
   59    61    62    35.00000  120.00000
   59    61    63    63.00000  120.00000
   61    59    60    35.00000  120.00000
   61    63    64    63.00000  120.00000
   61    63    52    70.00000  112.88000
   63    61    62    35.00000  120.00000
   63    64    65    35.00000  120.00000
   63    64    66    63.00000  120.00000
   63    52    47    60.00000  130.80000
   64    66    67    35.00000  120.00000
   64    66    68    63.00000  120.00000
   66    64    65    35.00000  120.00000
   66    68    47    70.00000  112.88000
   66    68    41    63.00000  120.00000
   68    66    67    35.00000  120.00000
   68    47    52    60.00000  130.80000
   68    41    43    60.00000  120.93500
   47    42    45    70.00000  112.88000
   52    56    57    70.00000  112.88000
   52    63    64    70.00000  112.88000
   41    38    39    63.00000  120.00000
   41    68    47    70.00000  112.88000
   41    43    44    40.00000  117.26300
   41    43    48    60.00000  123.20500
   43    48    49    35.00000  120.00000
   43    48    53    70.00000  124.00000
   48    43    44    35.00000  120.00000
   48    53    54    85.00000  110.90400
   48    53    55    35.00000  109.50000
   53    33    34    37.50000  110.70000
   53    33    38    70.00000  112.17500
   53    48    49    35.00000  117.00000
   55    53    54    45.00000  125.66300
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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   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  -0.16000  1.0 1.0
   29    33    38    39  -0.03200 -1.0 2.0
   29    33    38    39   0.04500  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    53    48   0.56750  1.0 1.0
   29    33    53    48  -0.07550 -1.0 2.0
   29    33    53    48   0.20000  1.0 3.0
   29    33    53    54   0.56750  1.0 1.0
   29    33    53    54  -0.07550 -1.0 2.0
   29    33    53    54   0.20000  1.0 3.0
   29    33    53    55   0.15000  1.0 3.0
   33    38    39    40   3.62500 -1.0 2.0
   33    38    39    42   3.62500 -1.0 2.0
   33    38    41    68   3.62500 -1.0 2.0
   33    38    41    43   3.62500 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    53    48   0.15000  1.0 3.0
   34    33    53    54   0.23400  1.0 3.0
   34    33    53    55   0.15000  1.0 3.0
   38    33    53    48   0.21200  1.0 1.0
   38    33    53    48   0.16900 -1.0 2.0
   38    33    53    48  -1.15100  1.0 3.0
   38    33    53    54  -0.64350  1.0 1.0
   38    33    53    54  -0.04200 -1.0 2.0
   38    33    53    54   0.19800  1.0 3.0
   38    33    53    55   0.43200  1.0 3.0
   38    39    42    45   3.62500 -1.0 2.0
   38    39    42    47   3.62500 -1.0 2.0
   38    41    43    44   0.56550  1.0 3.0
   38    41   -43    48   0.15800  1.0 1.0
   38    41   -43    48   1.85350 -1.0 2.0
   38    41   -43    48  -0.48700  1.0 3.0
   39    38    41    68   3.62500 -1.0 2.0
   39    38    41    43   3.62500 -1.0 2.0
   39    42    45    46   3.62500 -1.0 2.0
   39    42    45    50   3.62500 -1.0 2.0
   39    42   -47    68   3.62500 -1.0 2.0
   39    42    47    52   3.62500 -1.0 2.0
   40    39    42    45   3.62500 -1.0 2.0
   40    39    42    47   3.62500 -1.0 2.0
   42    45    50    51   3.62500 -1.0 2.0
   42    45    50    56   3.62500 -1.0 2.0
   42    47   -52    56   3.62500 -1.0 2.0
   42    47    52    63   3.62500 -1.0 2.0
   45    42    47    68   3.62500 -1.0 2.0
   45    42    47    52   3.62500 -1.0 2.0
   45    50    56    57   3.62500 -1.0 2.0
   45    50   -56    52   3.62500 -1.0 2.0
   46    45    50    51   3.62500 -1.0 2.0
   46    45    50    56   3.62500 -1.0 2.0
   50    56    57    58   3.62500 -1.0 2.0
   50    56    57    59   3.62500 -1.0 2.0
   50    56    52    63   3.62500 -1.0 2.0
   50    56    52    47   3.62500 -1.0 2.0
   51    50    56    57   3.62500 -1.0 2.0
   51    50    56    52   3.62500 -1.0 2.0
   56    57    59    60   3.62500 -1.0 2.0
   56    57    59    61   3.62500 -1.0 2.0
   57    56    52    63   3.62500 -1.0 2.0
   57    56    52    47   3.62500 -1.0 2.0
   57    59    61    62   3.62500 -1.0 2.0
   57    59   -61    63   3.62500 -1.0 2.0
   58    57    59    60   3.62500 -1.0 2.0
   58    57    59    61   3.62500 -1.0 2.0
   59    61    63    64   3.62500 -1.0 2.0
   59    61    63    52   3.62500 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    63   3.62500 -1.0 2.0
   61    63    64    65   3.62500 -1.0 2.0
   61    63    64    66   3.62500 -1.0 2.0
   61    63   -52    56   3.62500 -1.0 2.0
   61    63    52    47   3.62500 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    52   3.62500 -1.0 2.0
   63    64    66    67   3.62500 -1.0 2.0
   63    64    66    68   3.62500 -1.0 2.0
   64    63    52    56   3.62500 -1.0 2.0
   64    63    52    47   3.62500 -1.0 2.0
   64    66   -68    47   3.62500 -1.0 2.0
   64    66    68    41   3.62500 -1.0 2.0
   65    64    66    67   3.62500 -1.0 2.0
   65    64    66    68   3.62500 -1.0 2.0
   66    68    47    42   3.62500 -1.0 2.0
   66    68    47    52   3.62500 -1.0 2.0
   66    68    41    38   3.62500 -1.0 2.0
   66    68    41    43   3.62500 -1.0 2.0
   67    66    68    47   3.62500 -1.0 2.0
   67    66    68    41   3.62500 -1.0 2.0
   68    47    52    56   3.62500 -1.0 2.0
   68    47   -52    63   3.62500 -1.0 2.0
   68    41    43    44   0.56550  1.0 3.0
   68    41    43    48   0.15800  1.0 1.0
   68    41    43    48   1.85350 -1.0 2.0
   68    41    43    48  -0.48700  1.0 3.0
   47    42    45    46   3.62500 -1.0 2.0
   47    42   -45    50   3.62500 -1.0 2.0
   47    68   -41    38   3.62500 -1.0 2.0
   47    68    41    43   3.62500 -1.0 2.0
   52    56    57    58   3.62500 -1.0 2.0
   52    56   -57    59   3.62500 -1.0 2.0
   52    63    64    65   3.62500 -1.0 2.0
   52    63   -64    66   3.62500 -1.0 2.0
   41    38    39    40   3.62500 -1.0 2.0
   41    38    39    42   3.62500 -1.0 2.0
   41    68   -47    42   3.62500 -1.0 2.0
   41    68    47    52   3.62500 -1.0 2.0
   41    43    48    49   7.00000 -1.0 2.0
   41    43    48    53   7.00000 -1.0 2.0
   43    48   -53    33   0.09850  1.0 1.0
   43    48   -53    33   0.15250 -1.0 2.0
   43    48   -53    33  -0.50650  1.0 3.0
   43    48    53    54   0.39000  1.0 1.0
   43    48    53    54  -0.05800 -1.0 2.0
   43    48    53    54  -0.55150  1.0 3.0
   43    48    53    55   0.00000  1.0 1.0
   44    43    48    49   7.00000 -1.0 2.0
   44    43    48    53   7.00000 -1.0 2.0
   49    48    53    33   0.00000  1.0 1.0
   49    48    53    54   0.00000  1.0 1.0
   49    48    53    55   0.33100  1.0 3.0
   53    33    38    39   0.04150 -1.0 2.0
   53    33   -38    41   0.04150 -1.0 2.0
IPHI
    9     5     7     8  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    35    36  10.50000 -1.0 2.0
   39    41    38    33   4.00000 -1.0 2.0
   42    40    39    38   1.10000 -1.0 2.0
   45    47    42    39   4.00000 -1.0 2.0
   50    46    45    42   1.10000 -1.0 2.0
   56    51    50    45   1.10000 -1.0 2.0
   57    52    56    50   4.00000 -1.0 2.0
   59    58    57    56   1.10000 -1.0 2.0
   61    60    59    57   1.10000 -1.0 2.0
   63    62    61    59   1.10000 -1.0 2.0
   64    52    63    61   4.00000 -1.0 2.0
   66    65    64    63   1.10000 -1.0 2.0
   68    67    66    64   1.10000 -1.0 2.0
   47    41    68    66   4.00000 -1.0 2.0
   68    52    47    42   4.00000 -1.0 2.0
   63    47    52    56   4.00000 -1.0 2.0
   68    43    41    38   4.00000 -1.0 2.0
   41    44    43    48   1.10000 -1.0 2.0
   53    49    48    43   1.10000 -1.0 2.0
END
