* LIGAND DATABASE FILE (OPLS2005)
*
001      65    67    120    190     353
    1     0 S   NP   _N1_     1    28.96777    95.54653   -23.96158
    2     1 S   H    _HN1     2     1.02954    75.06315    16.39834
    3     1 S   H    _H1_     3     1.02828    33.60813   178.24142
    4     1 S   H    _H2_     4     1.02785   109.26495   -88.20181
    5     1 S   CT   _CA1     5     1.50115   133.16530   120.55022
    6     5 S   HC   _HA1     6     1.09574   105.20336    89.22962
    7     5 S   CO3  _C1_     7     1.53791   112.45331   -31.01059
    8     7 S   O2Z  _O11     8     1.26373   115.00654   -42.47360
    9     7 S   O2Z  _O12     9     1.26241   114.94671   136.66600
   10     5 S   CT   _CB1    10     1.53077   107.41841  -152.78503
   11    10 S   HC   HB11    11     1.09833   109.37435   -49.74938
   12    10 S   HC   HB12    12     1.09817   110.43835    66.85166
   13    10 S   CT   _CG1    13     1.52995   112.62099  -170.74360
   14    13 S   HC   HG11    14     1.09584   110.59878   -65.23061
   15    13 S   HC   HG12    15     1.09668   109.83420    54.01942
   16    13 S   C    _CD1    16     1.51786   112.23033   174.45362
   17    16 S   O    _OE1    17     1.22723   123.26862     5.33113
   18    16 S   N    _N2_    18     1.38642   111.67244  -174.79866
   19    18 S   H    _HN2    19     1.01582   118.99466     1.42793
   20    18 S   CT1  _CA2    20     1.46115   123.34604   177.99983
   21    20 S   HC   _HA2    21     1.09583   109.34529    -0.79130
   22    20 S   C    _C2_    22     1.53507   108.62417  -115.86461
   23    22 S   O    _O2_    23     1.23049   122.29395  -148.16607
   24    20 S   CT   _CB2    32     1.53281   111.67922   121.68724
   25    24 S   HC   HB21    33     1.09651   109.70344    61.24638
   26    24 S   HC   HB22    34     1.09568   110.95792   178.69734
   27    22 S   N    _N3_    24     1.38340   113.62590    39.30425
   28    27 S   H    _HN3    25     1.01603   119.52805    -3.36336
   29    24 S   S    _SG2    35     1.82855   114.39593   -58.59810
   30    27 S   CT   _CA3    26     1.45277   123.20337   177.02731
   31    30 S   HC   HA31    27     1.09550   107.52516   -64.09926
   32    30 S   HC   HA32    28     1.09556   107.96587    52.33243
   33    29 S   CT   _C4_    36     1.82854    99.72033   -66.97715
   34    33 S   HC   _H7_    37     1.09432   107.57909   -51.75573
   35    33 S   HC   _H8_    38     1.09332   108.49779    66.04057
   36    30 S   CO3  _C3_    29     1.52952   114.08391   174.31680
   37    36 S   O2Z  _O31    30     1.26373   116.06223    -0.74019
   38    36 S   O2Z  _O32    31     1.26426   114.41367   179.31500
   39    33 S   CT   _C5_    39     1.53624   110.88993  -172.53523
   40    39 S   HC   _H3_    40     1.09791   109.20831   -45.59758
   41    39 S   CDS  _C6_    41     1.54276   109.92330  -163.78183
   42    41 S   SD   _S1_    42     1.69095   119.75015    98.95420
   43    41 S   CT   _C7_    43     1.52979   118.86350   -83.74521
   44    43 S   SM   _S2_    44     1.83789   110.47384   100.75923
   45    43 S   HC   _H4_    45     1.09909   107.23715  -137.19982
   46    43 S   CT   _C8_    46     1.54096   109.01517   -19.97676
   47    46 S   HC   _H5_    47     1.10015   111.27940    87.92487
   48    46 S   CO   _C9_    48     1.54628   109.64436   -31.00984
   49    48 S   HC   _H6_    49     1.09842   111.14644   -49.07862
   50    48 S   NE   _N4_    50     1.45548   109.72383  -167.75519
   51    50 S   H    _H9_    51     1.01320   118.76097  -157.54341
   52    39 S   OS   _O33    65     1.42713   108.83524    69.59540
   53    50 S   CM   _C10    52     1.39523   123.35269    38.29026
   54    53 S   CM   _C11    53     1.35729   116.50660   -13.59876
   55    54 S   C    _C12    54     1.48458   119.06524   178.74820
   56    55 S   O    _O34    55     1.22722   122.21895  -179.59555
   57    46 S   NE   _N8_    63     1.46169   111.34526  -151.87523
   58    57 S   H    _H13    64     1.01580   118.95293   -41.14439
   59    55 S   N    _N5_    56     1.37550   113.87323     0.55214
   60    59 S   H    _H10    57     1.01345   117.75978   179.87967
   61    59 S   CDX  _C13    58     1.37988   123.36024     0.14265
   62    53 S   NI   _N6_    59     1.38082   120.78457   166.24110
   63    61 S   NE   _N7_    60     1.36621   115.87580   179.64723
   64    63 S   H    _H11    61     1.01376   120.39400  -179.96574
   65    63 S   H    _H12    62     1.01278   122.06545    -0.03956
  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
   9   5   4   2   1   1  11   5   9   5  11   5   4  11   7   9
   5   8   4   2   9   8   8   4   3   1   6   3   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    52  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    48    52  
   35    39    40    41    52  
   39    40    41    52  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    48    49    50    52  
   41    42    43    48    52  
   42    43    44    45    46    47    48    57    52  
   43    44    45    46    52  
   44    45    46    47    48    49    50    54    57    58    52  
   45    46    47    48    57  
   46    47    48    57  
   47    48    49    50    51    53    54    55    57    58    52  
   48    49    50    54    57    58    52  
   49    50    51    53    54    62    57    58    52  
   50    51    53    57    52  
   51    53    54    55    61    62    57    52  
   53    54    62    52  
   53    57  
   54    55    56    59    61    62    63    57    58  
   55    56    59    60    61    62    57    58  
   56    59    60    61    62    63    57    58  
   59    60    61    57  
   58    59    62  
    0  
   60    61    62    63    64    65  
   61    62    63  
   62    63    64    65  
   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   3.5000   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   3.7500   0.1050   0.476200   2.0020   1.7750   0.023028004  -0.852763146
   42   4.1000   0.3950  -0.476200   2.3050   2.0500   0.025682759  -1.666211680
   43   3.5000   0.0660  -0.200000   1.9750   1.7500   0.005000000  -0.741685710
   44   3.6000   0.3550  -0.900000   2.0300   1.8000   0.025682759  -1.666211680
   45   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.175300   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0150   0.100000   1.4250   1.2500   0.008598240   0.268726247
   50   3.2500   0.1700  -0.494200   2.1120   1.8750   0.051222218  -2.220205820
   51   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   52   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5500   0.0760   0.140500   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0760  -0.038700   2.0020   1.7750   0.023028004  -0.852763146
   55   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   57   3.2500   0.1700  -0.607000   2.1120   1.8750   0.051222218  -2.220205820
   58   0.5000   0.0300   0.353700   0.9960   0.8600   0.030040813  -0.651083722
   59   3.2500   0.1700  -0.422500   2.1120   1.8750   0.051222218  -2.220205820
   60   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   61   3.7500   0.1050   0.546500   2.1120   1.8750   0.001000000  -0.126889456
   62   3.2800   0.1700  -0.481500   1.9250   1.7000   0.054801302  -2.445846770
   63   3.2500   0.1700  -0.785000   2.1120   1.8750   0.051222218  -2.220205820
   64   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   65   0.5000   0.0300   0.360000   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   285.000  1.501
   39    52   320.000  1.410
   41    42   340.000  1.659
   41    43   285.000  1.501
   43    44   222.000  1.810
   43    45   340.000  1.090
   43    46   268.000  1.529
   46    47   340.000  1.090
   46    48   250.000  1.527
   46    57   382.000  1.448
   48    49   340.000  1.090
   48    50   320.000  1.442
   48    52   320.000  1.380
   50    51   434.000  1.010
   50    53   425.000  1.378
   53    54   549.000  1.340
   53    62   405.000  1.380
   54    55   410.000  1.444
   54    57   425.000  1.378
   55    56   570.000  1.229
   55    59   490.000  1.335
   59    60   434.000  1.010
   59    61   400.000  1.380
   61    62   650.000  1.285
   61    63   445.000  1.380
   63    64   434.000  1.010
   63    65   434.000  1.010
   57    58   434.000  1.010
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    70.00000  110.64500
   33    39    52    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    65.00000  123.03400
   39    41    43    65.00000  115.26000
   39    52    48    60.00000  109.50000
   41    39    40    45.00000  109.11000
   41    43    44    70.00000  112.33000
   41    43    45    45.00000  109.11000
   41    43    46    70.00000  110.64500
   43    41    42    65.00000  123.03400
   43    46    47    37.50000  110.70000
   43    46    48    75.00000  109.43000
   43    46    57    80.00000  111.61500
   45    43    44    35.00000  109.50000
   46    43    44    75.00000  111.63000
   46    43    45    37.50000  110.70000
   46    48    49    45.00000  112.01100
   46    48    50    85.00000  109.98000
   46    48    52    90.00000  108.56700
   46    57    54    50.00000  121.00000
   46    57    58    35.00000  112.50000
   48    46    47    45.00000  108.72000
   48    50    51    50.00000  113.12000
   48    50    53    50.00000  121.00000
   50    48    49    50.00000  108.16000
   50    53    54    70.00000  124.03900
   50    53    62    85.00000  113.56000
   53    50    51    35.00000  114.50000
   53    54    55    70.00000  118.70000
   53    54    57    70.00000  124.03900
   53    62    61    70.00000  116.49400
   54    55    56    80.00000  125.30000
   54    55    59    80.00000  111.56200
   54    57    58    35.00000  114.50000
   55    59    60    35.00000  119.80000
   55    59    61    70.00000  120.51600
   59    55    56    80.00000  122.90000
   59    61    62    80.00000  119.04400
   59    61    63    85.00000  111.44000
   61    59    60    45.00000  120.05200
   61    63    64    35.00000  119.50000
   61    63    65    35.00000  119.50000
   62    53    54    70.00000  120.83400
   63    61    62    75.00000  124.36500
   65    63    64    35.00000  109.00000
   57    46    47    35.00000  109.50000
   57    46    48    80.00000  111.61500
   57    54    55    70.00000  117.92000
   52    39    40    35.00000  109.50000
   52    39    41    90.00000  108.84000
   52    48    49    35.00000  109.50000
   52    48    50    95.00000  112.71300
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   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    52   0.56750  1.0 1.0
   29    33    39    52  -0.07550 -1.0 2.0
   29    33    39    52   0.20000  1.0 3.0
   33    39    41    42  -0.72750  1.0 1.0
   33    39    41    42   0.84450 -1.0 2.0
   33    39    41    43   0.60050  1.0 1.0
   33    39    41    43   0.05600 -1.0 2.0
   33    39    41    43   0.26150  1.0 3.0
   33    39    52    48   0.06250  1.0 1.0
   33    39    52    48  -0.01100 -1.0 2.0
   33    39    52    48   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    52   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    52   0.23400  1.0 3.0
   39    41    43    44   0.65300  1.0 1.0
   39    41    43    44  -0.03850 -1.0 2.0
   39    41    43    44   0.33900  1.0 3.0
   39    41    43    45   0.00000  1.0 1.0
   39    41    43    46   0.60050  1.0 1.0
   39    41    43    46   0.05600 -1.0 2.0
   39    41    43    46   0.26150  1.0 3.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    52    48   0.37050  1.0 3.0
   41    39    52    48  -1.11000  1.0 1.0
   41    39    52    48   0.50250 -1.0 2.0
   41    39    52    48   0.47450  1.0 3.0
   41    43    46    47  -0.11250  1.0 3.0
   41    43   -46    48  -0.95700  1.0 1.0
   41    43   -46    48  -0.18200 -1.0 2.0
   41    43   -46    48   0.29450  1.0 3.0
   41    43    46    57  -2.10200  1.0 1.0
   41    43    46    57  -0.31600 -1.0 2.0
   41    43    46    57   0.13050  1.0 3.0
   42    41    43    44   0.00000  1.0 1.0
   42    41    43    45   0.00000  1.0 1.0
   42    41    43    46  -0.72750  1.0 1.0
   42    41    43    46   0.84450 -1.0 2.0
   43    46    48    49   0.15000  1.0 3.0
   43    46    48    50   1.26750  1.0 1.0
   43    46    48    50  -0.00950 -1.0 2.0
   43    46    48    50   0.30600  1.0 3.0
   43    46    48    52   0.62750  1.0 1.0
   43    46    48    52  -0.30950 -1.0 2.0
   43    46    48    52   0.27300  1.0 3.0
   43    46    57    54   0.25450  1.0 1.0
   43    46    57    54  -0.61700 -1.0 2.0
   43    46    57    54  -0.23550  1.0 3.0
   43    46    57    58   0.00000  1.0 1.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    48   0.44750  1.0 1.0
   44    43    46    48  -0.17800 -1.0 2.0
   44    43    46    48   0.20200  1.0 3.0
   44    43    46    57   0.71400  1.0 1.0
   44    43    46    57   0.04300 -1.0 2.0
   44    43    46    57   0.01450  1.0 3.0
   45    43    46    47   0.15000  1.0 3.0
   45    43    46    48   0.15000  1.0 3.0
   45    43    46    57   0.22950  1.0 3.0
   46    48    50    51   0.00000  1.0 1.0
   46    48    50    53   0.25450  1.0 1.0
   46    48    50    53  -0.61700 -1.0 2.0
   46    48    50    53  -0.23550  1.0 3.0
   46    48   -52    39   0.06250  1.0 1.0
   46    48   -52    39  -0.01100 -1.0 2.0
   46    48   -52    39   0.28050  1.0 3.0
   47    46    48    49   0.15000  1.0 3.0
   47    46    48    50   0.22950  1.0 3.0
   47    46    48    52   0.23400  1.0 3.0
   47    46    57    54   0.00000  1.0 1.0
   47    46    57    58   0.00000  1.0 1.0
   48    46    57    54   0.25450  1.0 1.0
   48    46    57    54  -0.61700 -1.0 2.0
   48    46    57    54  -0.23550  1.0 3.0
   48    46    57    58   0.00000  1.0 1.0
   48    50   -53    54  -0.54700  1.0 1.0
   48    50   -53    54   1.23000 -1.0 2.0
   48    50    53    62   1.00000 -1.0 2.0
   49    48    50    51   0.00000  1.0 1.0
   49    48    50    53   0.00000  1.0 1.0
   49    48    52    39   0.37050  1.0 3.0
   50    48    52    39  -0.25000  1.0 1.0
   50    48    52    39  -0.75000 -1.0 2.0
   50    48    52    39   0.50000  1.0 3.0
   50    53    54    55   7.00000 -1.0 2.0
   50    53    54    57   7.00000 -1.0 2.0
   50    53    62    61   1.00000 -1.0 2.0
   51    50    53    54   1.00000 -1.0 2.0
   51    50    53    62   1.00000 -1.0 2.0
   53    54    55    56   1.00000 -1.0 2.0
   53    54    55    59   0.49500  1.0 1.0
   53    54    55    59   1.31600 -1.0 2.0
   53    54    55    59  -0.02300  1.0 3.0
   53    54   -57    46  -0.54700  1.0 1.0
   53    54   -57    46   1.23000 -1.0 2.0
   53    54    57    58   1.00000 -1.0 2.0
   54    53    62    61   1.00000 -1.0 2.0
   54    55    59    60   2.56700 -1.0 2.0
   54    55   -59    61   2.45000 -1.0 2.0
   55    54    57    46   1.00000 -1.0 2.0
   55    54    57    58   1.00000 -1.0 2.0
   55    59    61    62  -0.56400  1.0 1.0
   55    59    61    62   0.77500 -1.0 2.0
   55    59    61    62   0.18700  1.0 3.0
   55    59    61    63  -0.56400  1.0 1.0
   55    59    61    63   0.77500 -1.0 2.0
   55    59    61    63   0.18700  1.0 3.0
   56    55    59    60   2.45000 -1.0 2.0
   56    55    59    61   2.67200 -1.0 2.0
   59    61   -62    53   6.00000 -1.0 2.0
   59    61    63    64   1.00000 -1.0 2.0
   59    61    63    65   1.00000 -1.0 2.0
   60    59    61    62   1.00000 -1.0 2.0
   60    59    61    63   1.00000 -1.0 2.0
   62    53   -54    55   7.00000 -1.0 2.0
   62    53    54    57   7.00000 -1.0 2.0
   62    61    63    64   1.50000 -1.0 2.0
   62    61    63    65   1.50000 -1.0 2.0
   63    61    62    53   6.00000 -1.0 2.0
   57    46    48    49   0.22950  1.0 3.0
   57    46   -48    50   2.20050  1.0 1.0
   57    46   -48    50   0.63450 -1.0 2.0
   57    46   -48    50  -0.91300  1.0 3.0
   57    46    48    52   2.03850  1.0 1.0
   57    46    48    52  -0.40600 -1.0 2.0
   57    54    55    56  -0.52200  1.0 1.0
   57    54    55    56   0.82950 -1.0 2.0
   57    54    55    59   1.50000 -1.0 2.0
   52    39    41    42   0.00000  1.0 1.0
   52    39   -41    43   0.55300  1.0 1.0
   52    39   -41    43   1.25850 -1.0 2.0
   52    39   -41    43  -0.23600  1.0 3.0
   52    48    50    51  -1.49000  1.0 1.0
   52    48    50    51  -2.58450 -1.0 2.0
   52    48    50    53   0.75000  1.0 1.0
   52    48    50    53  -0.75000 -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
   39    43    41    42  10.50000 -1.0 2.0
   51    53    50    48   1.00000 -1.0 2.0
   50    62    53    54   1.10000 -1.0 2.0
   55    57    54    53   1.10000 -1.0 2.0
   54    59    55    56  10.50000 -1.0 2.0
   60    55    59    61   1.00000 -1.0 2.0
   59    63    61    62  10.50000 -1.0 2.0
   65    61    63    64   1.00000 -1.0 2.0
   58    54    57    46   1.00000 -1.0 2.0
END
