* LIGAND DATABASE FILE (OPLS2005)
*
001      73    75    138    211     400
    1     0 S   NP   _N1_     1    28.72233    95.19071   -20.64802
    2     1 S   H    _HN1     2     1.02959    88.09390    25.46077
    3     1 S   H    _H1_     3     1.02835    36.16907   148.34055
    4     1 S   H    _H2_     4     1.02780    85.74630   -83.06898
    5     1 S   CT   _CA1     5     1.50112   146.89282   151.43694
    6     5 S   HC   _HA1     6     1.09575   105.24272    57.23594
    7     5 S   CO3  _C1_     7     1.53795   112.36042   -62.99069
    8     7 S   O2Z  _O11     8     1.26359   115.01009   -44.77185
    9     7 S   O2Z  _O12     9     1.26239   114.91660   134.40346
   10     5 S   CT   _CB1    10     1.53092   107.42396   175.13413
   11    10 S   HC   HB11    11     1.09824   109.35493   -50.89461
   12    10 S   HC   HB12    12     1.09820   110.41242    65.65868
   13    10 S   CT   _CG1    13     1.53001   112.65723  -171.99997
   14    13 S   HC   HG11    14     1.09602   110.42294   -63.23961
   15    13 S   HC   HG12    15     1.09649   110.01213    55.98422
   16    13 S   C    _CD1    16     1.51809   112.30614   176.34516
   17    16 S   O    _OE1    17     1.22720   123.27339    -3.04485
   18    16 S   N    _N2_    18     1.38621   111.61989   177.11568
   19    18 S   H    _HN2    19     1.01587   119.02694     1.32899
   20    18 S   CT1  _CA2    20     1.46210   123.40290  -179.33031
   21    20 S   HC   _HA2    21     1.09733   109.42056    -8.40623
   22    20 S   C    _C2_    22     1.53472   108.45327  -124.09318
   23    22 S   O    _O2_    23     1.23028   122.16930  -146.40282
   24    20 S   CT   _CB2    32     1.53568   111.48029   113.63533
   25    24 S   HC   HB21    33     1.09433   109.05984    55.39568
   26    24 S   HC   HB22    34     1.09329   109.87753   174.21962
   27    22 S   N    _N3_    24     1.38480   113.44289    40.97088
   28    27 S   H    _HN3    25     1.01521   118.91649    -0.84673
   29    24 S   S    _SG2    35     1.82879   111.35855   -64.92842
   30    27 S   CT   _CA3    26     1.45462   123.59111   175.14102
   31    30 S   HC   HA31    27     1.09514   109.41643    20.74195
   32    30 S   HC   HA32    28     1.09504   107.07893   137.77779
   33    29 S   CT   _C15    36     1.90021   102.29910  -172.72020
   34    30 S   CO3  _C3_    29     1.52919   112.98207  -102.85590
   35    34 S   O2Z  _O31    30     1.26412   115.35505   -45.33274
   36    34 S   O2Z  _O32    31     1.26347   115.01113   135.55144
   37    33 S   CA   _C7_    37     1.51273   108.74930   -60.88308
   38    33 S   CT   _C14    50     1.53378   110.47410  -178.36314
   39    38 S   HC   _H4_    51     1.10060   111.42833   174.80657
   40    37 S   CA   _C6_    38     1.40365   121.24174    92.71730
   41    40 S   HA   _H9_    39     1.08803   119.55729    -0.65102
   42    38 S   OS   _O35    52     1.42440   105.04857   -70.71347
   43    40 S   CA   _C5_    40     1.40203   121.67584  -179.54500
   44    42 S   CO4  _C17    53     1.37467   107.37582   -31.39348
   45    44 S   O    _O34    54     1.22143   124.34640  -172.44005
   46    43 S   CA   _C10    41     1.40282   119.39420    -0.04846
   47    33 S   CT   _C16    55     1.54294   108.11479    75.02321
   48    47 S   HC   _H5_    56     1.09412   112.39865   -37.13286
   49    43 S   CT   _C4_    70     1.50399   119.55003   179.91377
   50    49 S   HC   _H6_    71     1.09480   110.22797   119.37079
   51    49 S   HC   _H7_    72     1.09482   110.22034  -119.72214
   52    49 S   HC   _H8_    73     1.09512   111.64645    -0.18975
   53    46 S   CA   _C9_    42     1.39943   119.39102     0.52265
   54    53 S   HA   _H10    43     1.08644   120.40289  -179.07190
   55    47 S   CT   _C18    57     1.52934   117.38513  -164.49420
   56    55 S   HC   _H16    58     1.09420   112.67125   -49.61847
   57    55 S   HC   _H17    59     1.09633   110.26170  -168.79779
   58    55 S   HC   _H18    60     1.09245   111.75355    72.36781
   59    46 S   OS   _O33    65     1.37209   115.81192  -179.43007
   60    37 S   CA   _C8_    44     1.41508   119.73591   -85.45505
   61    59 S   CT   _C11    66     1.42229   117.40093  -178.90033
   62    61 S   HC   _H11    67     1.09429   107.73070   179.15930
   63    61 S   HC   _H12    68     1.09499   111.17572    61.43712
   64    61 S   HC   _H13    69     1.09491   111.10848   -63.16201
   65    60 S   CT   _C12    45     1.53367   122.65557    -2.22871
   66    65 S   HC   _H3_    46     1.09966   105.64366  -121.55143
   67    65 S   CT   _C13    47     1.54645   115.69919    -4.42881
   68    67 S   HC   _H14    48     1.09622   111.95868   101.88364
   69    67 S   HC   _H15    49     1.09809   109.66733  -143.49973
   70    65 S   CT   _C19    61     1.53426   111.93830   121.33835
   71    70 S   HC   _H19    62     1.09595   111.14539   -60.17440
   72    70 S   HC   _H20    63     1.09557   110.70514   179.67555
   73    70 S   HC   _H21    64     1.09465   111.94012    60.10256
  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  12   5   4   3
  21   2   1   1  19  15   7  12   4   9  10   8   3  13   7   4
   5   2   1   1   8   3   3   2   1   1   5   9   3   2   1   1
   8   7   6   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    60    67    38    39    42    44    47    48    55  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    43    53    60    65    67    68    69    38    39    42    44    45    47    48    55    56    57    58  
   35    36  
   36  
    0  
   40    41    43    46    53    54    60    65    66    67    38    39    42    44    47    48    55    70    49  
   39    42    44    45    47    48    55    70    40    60    65    66    67    68    69  
   42    44    47    65    67    68    69  
   41    43    46    53    60    65    47    59    49    50    51    52  
   43    46    60    49  
   44    45    47    48    55    65    67    68    69  
   46    53    54    60    59    61    49    50    51    52  
   45    47    48    55    56    57    58    67  
   47    48    55  
   53    54    60    65    59    61    62    63    64    49    50    51    52  
   48    55    56    57    58    60    67  
   55    56    57    58  
   50    51    52    53    59  
   51    52  
   52  
    0  
   54    60    65    66    67    70    59    61  
   60    65    59  
   56    57    58  
   57    58  
   58  
    0  
   61    62    63    64    60  
   65    66    67    68    69    70    71    72    73  
   62    63    64  
   63    64  
   64  
    0  
   66    67    68    69    70    71    72    73  
   67    68    69    70    71    72    73  
   68    69    70    71    72    73  
   69    70  
   70  
   71    72    73  
   72    73  
   73  
    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   0.282500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   49   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   61   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.055000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    38   268.000  1.529
   33    47   268.000  1.529
   37    40   469.000  1.400
   37    60   469.000  1.400
   40    41   367.000  1.080
   40    43   469.000  1.400
   43    46   469.000  1.400
   43    49   317.000  1.510
   46    53   469.000  1.400
   46    59   450.000  1.364
   53    54   367.000  1.080
   53    60   469.000  1.400
   60    65   317.000  1.510
   65    66   340.000  1.090
   65    67   268.000  1.529
   65    70   268.000  1.529
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    38   268.000  1.529
   38    39   340.000  1.090
   38    42   320.000  1.410
   42    44   214.000  1.327
   44    45   570.000  1.229
   44    47   317.000  1.522
   47    48   340.000  1.090
   47    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   59    61   320.000  1.410
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    80.00000  109.48900
   29    33    38    75.00000  111.63000
   29    33    47    75.00000  111.63000
   33    37    40    70.00000  120.00000
   33    37    60    70.00000  120.00000
   33    38    67    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    42    50.00000  109.50000
   33    47    44    63.00000  111.10000
   33    47    48    37.50000  110.70000
   33    47    55    58.35000  112.70000
   37    40    41    35.00000  120.00000
   37    40    43    63.00000  120.00000
   37    60    53    63.00000  120.00000
   37    60    65    70.00000  120.00000
   40    43    46    63.00000  120.00000
   40    43    49    70.00000  120.00000
   43    40    41    35.00000  120.00000
   43    46    53    63.00000  120.00000
   43    46    59    70.00000  120.00000
   43    49    50    35.00000  109.50000
   43    49    51    35.00000  109.50000
   43    49    52    35.00000  109.50000
   46    53    54    35.00000  120.00000
   46    53    60    63.00000  120.00000
   46    59    61    75.00000  111.00000
   53    60    65    70.00000  120.00000
   60    37    40    63.00000  120.00000
   60    53    54    35.00000  120.00000
   60    65    66    35.00000  109.50000
   60    65    67    70.00000  112.17500
   60    65    70    70.00000  112.17500
   65    67    68    37.50000  110.70000
   65    67    69    37.50000  110.70000
   65    67    38    58.35000  112.70000
   65    70    71    37.50000  110.70000
   65    70    72    37.50000  110.70000
   65    70    73    37.50000  110.70000
   67    65    66    37.50000  110.70000
   67    38    39    37.50000  110.70000
   67    38    42    50.00000  109.50000
   69    67    68    33.00000  107.80000
   38    33    37    70.00000  112.17500
   38    67    68    37.50000  110.70000
   38    67    69    37.50000  110.70000
   38    42    44    83.00000  116.90000
   42    38    39    35.00000  109.50000
   42    44    45    83.00000  123.40000
   42    44    47    81.00000  111.40000
   44    47    48    35.00000  109.50000
   44    47    55    63.00000  111.10000
   47    33    37    70.00000  112.17500
   47    33    38    58.35000  112.70000
   47    44    45    80.00000  120.40000
   47    55    56    37.50000  110.70000
   47    55    57    37.50000  110.70000
   47    55    58    37.50000  110.70000
   55    47    48    37.50000  110.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   70    65    66    37.50000  110.70000
   70    65    67    58.35000  112.70000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   59    46    53    70.00000  120.00000
   59    61    62    35.00000  109.50000
   59    61    63    35.00000  109.50000
   59    61    64    35.00000  109.50000
   63    61    62    33.00000  107.80000
   64    61    62    33.00000  107.80000
   64    61    63    33.00000  107.80000
   49    43    46    70.00000  120.00000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.23050  1.0 1.0
   24    29    33    37   0.06200 -1.0 2.0
   24    29    33    37   0.47200  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    47   0.01700  1.0 1.0
   24    29    33    47  -0.23550 -1.0 2.0
   24    29    33    47   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    37    40  -0.16000  1.0 1.0
   29    33    37    40  -0.03200 -1.0 2.0
   29    33    37    40   0.04500  1.0 3.0
   29    33    37    60  -0.16000  1.0 1.0
   29    33    37    60  -0.03200 -1.0 2.0
   29    33    37    60   0.04500  1.0 3.0
   29    33    38    67   0.44750  1.0 1.0
   29    33    38    67  -0.17800 -1.0 2.0
   29    33    38    67   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    47    44   0.56750  1.0 1.0
   29    33    47    44  -0.07550 -1.0 2.0
   29    33    47    44   0.20000  1.0 3.0
   29    33    47    48   0.15000  1.0 3.0
   29    33    47    55   0.44750  1.0 1.0
   29    33    47    55  -0.17800 -1.0 2.0
   29    33    47    55   0.20200  1.0 3.0
   33    37    40    41   3.62500 -1.0 2.0
   33    37    40    43   3.62500 -1.0 2.0
   33    37    60    53   3.62500 -1.0 2.0
   33    37    60    65   3.62500 -1.0 2.0
   33    38   -42    44  -0.25900  1.0 1.0
   33    38   -42    44  -0.47000 -1.0 2.0
   33    38   -42    44   0.11750  1.0 3.0
   33    47    55    56   0.15000  1.0 3.0
   33    47    55    57   0.15000  1.0 3.0
   33    47    55    58   0.15000  1.0 3.0
   37    33    38    67  -0.03700  1.0 1.0
   37    33    38    67   0.37200 -1.0 2.0
   37    33    38    67  -0.47300  1.0 3.0
   37    33    38    39   0.43200  1.0 3.0
   37    33    38    42  -0.64350  1.0 1.0
   37    33    38    42  -0.04200 -1.0 2.0
   37    33    38    42   0.19800  1.0 3.0
   37    33    47    44   0.56750  1.0 1.0
   37    33    47    44  -0.07550 -1.0 2.0
   37    33    47    44   0.20000  1.0 3.0
   37    33    47    48   0.43200  1.0 3.0
   37    33    47    55  -0.03700  1.0 1.0
   37    33    47    55   0.37200 -1.0 2.0
   37    33    47    55  -0.47300  1.0 3.0
   37    40    43    46   3.62500 -1.0 2.0
   37    40    43    49   3.62500 -1.0 2.0
   37    60    65    66   0.00000  1.0 1.0
   37    60   -65    67   0.04150 -1.0 2.0
   37    60    65    70   0.04150 -1.0 2.0
   40    37    60    53   3.62500 -1.0 2.0
   40    37    60    65   3.62500 -1.0 2.0
   40    43   -46    53   3.62500 -1.0 2.0
   40    43    46    59   3.62500 -1.0 2.0
   40    43    49    50   0.00000  1.0 1.0
   40    43    49    51   0.00000  1.0 1.0
   40    43    49    52   0.00000  1.0 1.0
   41    40    43    46   3.62500 -1.0 2.0
   41    40    43    49   3.62500 -1.0 2.0
   43    46    53    54   3.62500 -1.0 2.0
   43    46    53    60   3.62500 -1.0 2.0
   43    46    59    61   1.63200 -1.0 2.0
   46    43    49    50   0.00000  1.0 1.0
   46    43    49    51   0.00000  1.0 1.0
   46    43    49    52   0.00000  1.0 1.0
   46    53   -60    37   3.62500 -1.0 2.0
   46    53    60    65   3.62500 -1.0 2.0
   46    59    61    62   0.08050  1.0 3.0
   46    59    61    63   0.08050  1.0 3.0
   46    59    61    64   0.08050  1.0 3.0
   53    46    59    61   1.63200 -1.0 2.0
   53    60    65    66   0.00000  1.0 1.0
   53    60    65    67   0.04150 -1.0 2.0
   53    60    65    70   0.04150 -1.0 2.0
   54    53    60    37   3.62500 -1.0 2.0
   54    53    60    65   3.62500 -1.0 2.0
   60    37    40    41   3.62500 -1.0 2.0
   60    37   -40    43   3.62500 -1.0 2.0
   60    65    67    68   0.43200  1.0 3.0
   60    65    67    69   0.43200  1.0 3.0
   60    65    67    38  -0.03700  1.0 1.0
   60    65    67    38   0.37200 -1.0 2.0
   60    65    67    38  -0.47300  1.0 3.0
   60    65    70    71   0.43200  1.0 3.0
   60    65    70    72   0.43200  1.0 3.0
   60    65    70    73   0.43200  1.0 3.0
   65    67   -38    33   0.56750  1.0 1.0
   65    67   -38    33  -0.07550 -1.0 2.0
   65    67   -38    33   0.20000  1.0 3.0
   65    67    38    39   0.15000  1.0 3.0
   65    67    38    42   0.62750  1.0 1.0
   65    67    38    42  -0.30950 -1.0 2.0
   65    67    38    42   0.27300  1.0 3.0
   66    65    67    68   0.15000  1.0 3.0
   66    65    67    69   0.15000  1.0 3.0
   66    65    67    38   0.15000  1.0 3.0
   66    65    70    71   0.15000  1.0 3.0
   66    65    70    72   0.15000  1.0 3.0
   66    65    70    73   0.15000  1.0 3.0
   67    65    70    71   0.15000  1.0 3.0
   67    65    70    72   0.15000  1.0 3.0
   67    65    70    73   0.15000  1.0 3.0
   67    38    42    44  -0.25900  1.0 1.0
   67    38    42    44  -0.47000 -1.0 2.0
   67    38    42    44   0.11750  1.0 3.0
   68    67    38    33   0.15000  1.0 3.0
   68    67    38    39   0.15000  1.0 3.0
   68    67    38    42   0.23400  1.0 3.0
   69    67    38    33   0.15000  1.0 3.0
   69    67    38    39   0.15000  1.0 3.0
   69    67    38    42   0.23400  1.0 3.0
   38    33    37    40   0.04150 -1.0 2.0
   38    33   -37    60   0.04150 -1.0 2.0
   38    33   -47    44  -0.95700  1.0 1.0
   38    33   -47    44  -0.18200 -1.0 2.0
   38    33   -47    44   0.29450  1.0 3.0
   38    33    47    48   0.15000  1.0 3.0
   38    33    47    55   0.56750  1.0 1.0
   38    33    47    55  -0.07550 -1.0 2.0
   38    33    47    55   0.20000  1.0 3.0
   38    42    44    45   3.00000 -1.0 2.0
   38    42   -44    47   1.63150  1.0 1.0
   38    42   -44    47   2.92000 -1.0 2.0
   39    38    42    44   0.08050  1.0 3.0
   42    44   -47    33   0.36750  1.0 3.0
   42    44    47    48   0.00000  1.0 1.0
   42    44    47    55   0.36750  1.0 3.0
   44    47    55    56  -0.11250  1.0 3.0
   44    47    55    57  -0.11250  1.0 3.0
   44    47    55    58  -0.11250  1.0 3.0
   45    44    47    33   0.30150 -1.0 2.0
   45    44    47    48   0.00000  1.0 1.0
   45    44    47    55   0.30150 -1.0 2.0
   47    33    37    40   0.04150 -1.0 2.0
   47    33    37    60   0.04150 -1.0 2.0
   47    33    38    67   0.56750  1.0 1.0
   47    33    38    67  -0.07550 -1.0 2.0
   47    33    38    67   0.20000  1.0 3.0
   47    33    38    39   0.15000  1.0 3.0
   47    33   -38    42   0.62750  1.0 1.0
   47    33   -38    42  -0.30950 -1.0 2.0
   47    33   -38    42   0.27300  1.0 3.0
   48    47    55    56   0.15000  1.0 3.0
   48    47    55    57   0.15000  1.0 3.0
   48    47    55    58   0.15000  1.0 3.0
   70    65    67    68   0.15000  1.0 3.0
   70    65    67    69   0.15000  1.0 3.0
   70    65    67    38   0.56750  1.0 1.0
   70    65    67    38  -0.07550 -1.0 2.0
   70    65    67    38   0.20000  1.0 3.0
   59    46    53    54   3.62500 -1.0 2.0
   59    46    53    60   3.62500 -1.0 2.0
   49    43    46    53   3.62500 -1.0 2.0
   49    43    46    59   3.62500 -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
   35    30    34    36  10.50000 -1.0 2.0
   40    60    37    33   4.00000 -1.0 2.0
   43    41    40    37   1.10000 -1.0 2.0
   46    49    43    40   4.00000 -1.0 2.0
   53    59    46    43   4.00000 -1.0 2.0
   60    54    53    46   1.10000 -1.0 2.0
   53    65    60    37   4.00000 -1.0 2.0
   42    47    44    45  10.50000 -1.0 2.0
END
