* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    134    201     387
    1     0 S   NP   _N1_     1    29.37701    91.05853   -22.77030
    2     1 S   H    _HN1     2     1.02773   105.39267   -71.13030
    3     1 S   H    _H1_     3     1.02997   101.38523    41.59439
    4     1 S   H    _H2_     4     1.02825     7.89745   178.88724
    5     1 S   CT   _CA1     5     1.50199   118.41199   162.39575
    6     5 S   HC   _HA1     6     1.09560   105.38455    62.04963
    7     5 S   CO3  _C1_     7     1.53805   112.16115   -58.37377
    8     7 S   O2Z  _O11     8     1.26366   115.03595   -46.95621
    9     7 S   O2Z  _O12     9     1.26238   114.89867   132.15230
   10     5 S   CT   _CB1    10     1.52934   107.18391   179.97202
   11    10 S   HC   HB11    11     1.09814   109.39667   -51.39647
   12    10 S   HC   HB12    12     1.09685   110.01898    64.99389
   13    10 S   CT   _CG1    13     1.52970   113.27565  -172.81384
   14    13 S   HC   HG11    14     1.09577   110.41759   -58.88528
   15    13 S   HC   HG12    15     1.09599   110.29330    60.58154
   16    13 S   C    _CD1    16     1.51829   111.58336  -179.20034
   17    16 S   O    _OE1    17     1.22791   123.04713   -11.87026
   18    16 S   N    _N2_    18     1.38660   111.96388   168.33264
   19    18 S   H    _HN2    19     1.01584   119.20535     2.29823
   20    18 S   CT1  _CA2    20     1.46229   122.98492  -176.89272
   21    20 S   HC   _HA2    21     1.09684   109.02913   -12.25141
   22    20 S   C    _C2_    22     1.53327   108.86197  -127.83126
   23    22 S   O    _O2_    23     1.23045   122.29957  -149.80272
   24    20 S   CT   _CB2    32     1.53669   111.88296   109.40536
   25    24 S   HC   HB21    33     1.09617   110.01221    60.29018
   26    24 S   HC   HB22    34     1.09361   110.08125   177.79282
   27    22 S   N    _N3_    24     1.38343   113.53678    37.66925
   28    27 S   H    _HN3    25     1.01656   119.45482    -3.55099
   29    24 S   S    _SG2    35     1.83167   111.76379   -58.50695
   30    27 S   CT   _CA3    26     1.45294   123.09749   176.93510
   31    30 S   HC   HA31    27     1.09553   107.48504   -64.58337
   32    30 S   HC   HA32    28     1.09560   107.97876    51.80917
   33    29 S   CT   _C15    36     1.86126   102.86562  -124.81626
   34    30 S   CO3  _C3_    29     1.52927   114.18369   173.81518
   35    34 S   O2Z  _O31    30     1.26359   116.06367    -1.27733
   36    34 S   O2Z  _O32    31     1.26438   114.40928   178.80531
   37    33 S   CO4  _C9_    37     1.53321   110.26132    52.52877
   38    37 S   O    _O18    38     1.23020   123.74514    30.51612
   39    33 S   CT   _C14    48     1.56531   109.61905   170.83282
   40    39 S   HC   _H29    49     1.09714   109.76049  -177.82399
   41    37 S   CM   _C5_    39     1.48540   118.01336  -153.86400
   42    41 S   HC   _H22    40     1.08465   117.02492  -169.39843
   43    39 S   CM   _C6_    50     1.49401   116.48853   -54.97954
   44    43 S   HC   _H23    51     1.08034   124.76015   -59.04130
   45    41 S   CM   _C4_    41     1.33419   122.07796     8.80194
   46    45 S   HC   _H21    42     1.08409   121.27342  -177.43692
   47    43 S   CM   _C7_    52     1.33248   110.11303   119.42565
   48    45 S   CO4  _C8_    43     1.47897   121.24001     3.89526
   49    48 S   O    _O17    44     1.22862   119.82645  -172.23095
   50    47 S   CT   _C12    53     1.48487   109.77395     1.78169
   51    50 S   HC   _H25    54     1.09380   112.02120   118.89911
   52    50 S   HC   _H26    55     1.09372   112.30312  -117.40440
   53    47 S   CT   _C18    57     1.49181   127.36460  -177.71792
   54    53 S   HC   _H36    58     1.09706   109.35991  -133.47897
   55    53 S   HC   _H37    59     1.09795   109.56893   -17.34737
   56    33 S   CT   _C13    45     1.53854   107.58467   -68.24499
   57    56 S   HC   _H27    46     1.09688   112.29781    50.37309
   58    56 S   HC   _H28    47     1.09639   111.27115   -69.79748
   59    39 S   OS   _O19    56     1.44835   110.81191    65.15692
   60    53 S   CT   _C19    60     1.53102   111.45552   103.95679
   61    60 S   HC   _H38    61     1.09539   110.29186   -54.45678
   62    60 S   HC   _H39    62     1.09761   110.16885    61.51138
   63    60 S   CM   _C10    63     1.50308   111.64088  -178.69224
   64    63 S   HC   _H24    64     1.08930   114.26230   -83.07253
   65    63 S   CM   _C11    65     1.34671   127.38625    97.87064
   66    65 S   CT   _C16    66     1.50505   120.55764   178.50721
   67    66 S   HC   _H30    67     1.09490   110.29647   119.16208
   68    66 S   HC   _H31    68     1.09508   112.39232    -1.00678
   69    66 S   HC   _H32    69     1.09500   110.18730  -121.01953
   70    65 S   CT   _C17    70     1.50294   124.94709    -2.50155
   71    70 S   HC   _H33    71     1.09461   110.12455   117.38319
   72    70 S   HC   _H34    72     1.09531   109.99958  -123.40071
   73    70 S   HC   _H35    73     1.09239   113.48908    -3.62850
  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
  17   2   1   1  13   5  14   6   6   3  11   4   6   3  11   4
   3   7   3   2   9   5   4   3   1   1   1   7   4   3  10   3
   8   7   3   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    56    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    48    56    57    58    39    40    43    59  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    45    48    49    56    57    58    39    40    43    44    47    50    59  
   35    36  
   36  
    0  
   38    41    42    45    46    48    56    57    58    39    40    43    59  
   41    42    45    56    39  
   40    43    44    47    50    51    52    59    53    41    48    56    57    58  
   43    44    47    50    59    56  
   42    45    46    48    49    56  
   45    46    48  
   44    47    50    51    52    59    53    54    55    60    56  
   47    50    59    53  
   46    48    49    56    57    58  
   48    49    56  
   50    51    52    59    53    54    55    60    61    62    63  
   49    56    57    58  
   56    57    58  
   51    52    59    53    54    55    60  
   52    59    53  
   59    53  
   54    55    60    61    62    63    64    65    59  
   55    60    61    62    63  
   60    61    62    63  
   57    58    59  
   58  
    0  
    0  
   61    62    63    64    65    66    70  
   62    63    64    65  
   63    64    65  
   64    65    66    67    68    69    70    71    72    73  
   65    66    70  
   66    67    68    69    70    71    72    73  
   67    68    69    70    71    72    73  
   68    69    70  
   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   0.167500   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   42   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760  -0.184000   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   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760  -0.069000   2.0020   1.7750   0.023028004  -0.852763146
   48   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   50   3.5000   0.0660   0.209000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   64   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   66   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  1.522
   33    56   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    41   320.000  1.462
   41    42   340.000  1.080
   41    45   549.000  1.340
   45    46   340.000  1.080
   45    48   320.000  1.462
   48    49   570.000  1.229
   48    56   317.000  1.522
   56    57   340.000  1.090
   56    58   340.000  1.090
   39    40   340.000  1.090
   39    43   317.000  1.510
   39    59   320.000  1.410
   43    44   340.000  1.080
   43    47   549.000  1.340
   47    50   317.000  1.510
   47    53   317.000  1.510
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    59   320.000  1.410
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   317.000  1.510
   63    64   340.000  1.080
   63    65   549.000  1.340
   65    66   317.000  1.510
   65    70   317.000  1.510
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   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    75.00000  110.18000
   29    33    56    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    41    65.00000  118.62400
   33    56    48    63.00000  111.10000
   33    56    57    37.50000  110.70000
   33    56    58    37.50000  110.70000
   33    39    40    37.50000  110.70000
   33    39    43    70.00000  112.02700
   33    39    59    50.00000  109.50000
   37    41    42    40.00000  117.72500
   37    41    45    65.00000  118.96000
   41    37    38    80.00000  123.72100
   41    45    46    35.00000  120.00000
   41    45    48    65.00000  118.96000
   45    41    42    35.00000  120.00000
   45    48    49    80.00000  123.72100
   45    48    56    65.00000  118.62400
   48    45    46    40.00000  117.72500
   48    56    57    35.00000  109.50000
   48    56    58    35.00000  109.50000
   56    33    37    63.00000  111.10000
   56    48    49    80.00000  120.40000
   58    56    57    33.00000  107.80000
   39    33    37    63.00000  111.10000
   39    33    56    58.35000  112.70000
   39    43    44    35.00000  117.00000
   39    43    47    70.00000  124.00000
   39    59    50    60.00000  109.50000
   43    39    40    35.00000  109.50000
   43    47    50    70.00000  124.00000
   43    47    53    70.00000  124.00000
   47    43    44    35.00000  120.00000
   47    50    51    35.00000  109.50000
   47    50    52    35.00000  109.50000
   47    50    59    85.00000  110.90400
   47    53    54    35.00000  109.50000
   47    53    55    35.00000  109.50000
   47    53    60    70.00000  112.02700
   52    50    51    33.00000  107.80000
   59    39    40    35.00000  109.50000
   59    39    43    85.00000  110.90400
   59    50    51    35.00000  109.50000
   59    50    52    35.00000  109.50000
   53    47    50    65.00000  117.92700
   53    60    61    37.50000  110.70000
   53    60    62    37.50000  110.70000
   53    60    63    70.00000  112.02700
   55    53    54    33.00000  107.80000
   60    53    54    37.50000  110.70000
   60    53    55    37.50000  110.70000
   60    63    64    35.00000  117.00000
   60    63    65    70.00000  124.00000
   62    60    61    33.00000  107.80000
   63    60    61    35.00000  109.50000
   63    60    62    35.00000  109.50000
   63    65    66    70.00000  124.00000
   63    65    70    70.00000  124.00000
   65    63    64    35.00000  120.00000
   65    66    67    35.00000  109.50000
   65    66    68    35.00000  109.50000
   65    66    69    35.00000  109.50000
   65    70    71    35.00000  109.50000
   65    70    72    35.00000  109.50000
   65    70    73    35.00000  109.50000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   70    65    66    65.00000  117.92700
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    56   0.01700  1.0 1.0
   24    29    33    56  -0.23550 -1.0 2.0
   24    29    33    56   0.21350  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    37    38   0.30150 -1.0 2.0
   29    33    37    41   0.65300  1.0 1.0
   29    33    37    41  -0.03850 -1.0 2.0
   29    33    37    41   0.33900  1.0 3.0
   29    33    56    48   0.56750  1.0 1.0
   29    33    56    48  -0.07550 -1.0 2.0
   29    33    56    48   0.20000  1.0 3.0
   29    33    56    57   0.15000  1.0 3.0
   29    33    56    58   0.15000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   29    33    39    59   0.56750  1.0 1.0
   29    33    39    59  -0.07550 -1.0 2.0
   29    33    39    59   0.20000  1.0 3.0
   33    37    41    42   0.04550  1.0 1.0
   33    37    41    42   0.83000 -1.0 2.0
   33    37    41    42  -0.04000  1.0 3.0
   33    37    41    45  -0.33500  1.0 1.0
   33    37    41    45   1.06600 -1.0 2.0
   33    37    41    45  -0.14000  1.0 3.0
   33    39    43    44   0.00000  1.0 1.0
   33    39    43    47   0.09850  1.0 1.0
   33    39    43    47   0.15250 -1.0 2.0
   33    39    43    47  -0.50650  1.0 3.0
   33    39    59    50   0.06250  1.0 1.0
   33    39    59    50  -0.01100 -1.0 2.0
   33    39    59    50   0.28050  1.0 3.0
   37    33    56    48   0.11950  1.0 1.0
   37    33    56    48   0.20300 -1.0 2.0
   37    33    56    48  -0.70800  1.0 3.0
   37    33    56    57  -0.11250  1.0 3.0
   37    33    56    58  -0.11250  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    43  -0.98800  1.0 1.0
   37    33    39    43   0.48800 -1.0 2.0
   37    33    39    43   0.76800  1.0 3.0
   37    33    39    59  -0.09450  1.0 1.0
   37    33    39    59  -1.12950 -1.0 2.0
   37    33    39    59   0.54000  1.0 3.0
   37    41    45    46   7.00000 -1.0 2.0
   37    41   -45    48   7.00000 -1.0 2.0
   38    37    41    42   0.00000  1.0 1.0
   38    37    41    45   1.00000 -1.0 2.0
   41    45    48    49   1.00000 -1.0 2.0
   41    45    48    56  -0.33500  1.0 1.0
   41    45    48    56   1.06600 -1.0 2.0
   41    45    48    56  -0.14000  1.0 3.0
   42    41    45    46   7.00000 -1.0 2.0
   42    41    45    48   7.00000 -1.0 2.0
   45    48   -56    33   0.65300  1.0 1.0
   45    48   -56    33  -0.03850 -1.0 2.0
   45    48   -56    33   0.33900  1.0 3.0
   45    48    56    57   0.00000  1.0 1.0
   45    48    56    58   0.00000  1.0 1.0
   46    45    48    49   0.00000  1.0 1.0
   46    45    48    56   0.04550  1.0 1.0
   46    45    48    56   0.83000 -1.0 2.0
   46    45    48    56  -0.04000  1.0 3.0
   49    48    56    33   0.30150 -1.0 2.0
   49    48    56    57   0.00000  1.0 1.0
   49    48    56    58   0.00000  1.0 1.0
   56    33    37    38   0.30150 -1.0 2.0
   56    33   -37    41   0.65300  1.0 1.0
   56    33   -37    41  -0.03850 -1.0 2.0
   56    33   -37    41   0.33900  1.0 3.0
   56    33    39    40   0.15000  1.0 3.0
   56    33    39    43   0.34400  1.0 1.0
   56    33    39    43   0.09450 -1.0 2.0
   56    33    39    43   0.11100  1.0 3.0
   56    33    39    59   0.62750  1.0 1.0
   56    33    39    59  -0.30950 -1.0 2.0
   56    33    39    59   0.27300  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    41   0.65300  1.0 1.0
   39    33    37    41  -0.03850 -1.0 2.0
   39    33    37    41   0.33900  1.0 3.0
   39    33    56    48  -0.95700  1.0 1.0
   39    33    56    48  -0.18200 -1.0 2.0
   39    33    56    48   0.29450  1.0 3.0
   39    33    56    57   0.15000  1.0 3.0
   39    33    56    58   0.15000  1.0 3.0
   39    43   -47    50   7.00000 -1.0 2.0
   39    43    47    53   7.00000 -1.0 2.0
   40    39    43    44   0.33100  1.0 3.0
   40    39    43    47   0.00000  1.0 1.0
   40    39    59    50   0.37050  1.0 3.0
   43    39   -59    50  -0.77900  1.0 1.0
   43    39   -59    50  -0.36900 -1.0 2.0
   43    39   -59    50   0.40400  1.0 3.0
   43    47    50    51   0.00000  1.0 1.0
   43    47    50    52   0.00000  1.0 1.0
   43    47   -50    59   0.39000  1.0 1.0
   43    47   -50    59  -0.05800 -1.0 2.0
   43    47   -50    59  -0.55150  1.0 3.0
   43    47    53    54   0.00000  1.0 1.0
   43    47    53    55   0.00000  1.0 1.0
   43    47    53    60   0.09850  1.0 1.0
   43    47    53    60   0.15250 -1.0 2.0
   43    47    53    60  -0.50650  1.0 3.0
   44    43    47    50   7.00000 -1.0 2.0
   44    43    47    53   7.00000 -1.0 2.0
   47    50   -59    39  -0.77900  1.0 1.0
   47    50   -59    39  -0.36900 -1.0 2.0
   47    50   -59    39   0.40400  1.0 3.0
   47    53    60    61   0.15000  1.0 3.0
   47    53    60    62   0.15000  1.0 3.0
   47    53    60    63   0.31000  1.0 1.0
   47    53    60    63   0.14700 -1.0 2.0
   47    53    60    63   0.07550  1.0 3.0
   50    47    53    54   0.34800  1.0 3.0
   50    47    53    55   0.34800  1.0 3.0
   50    47    53    60   0.46850  1.0 1.0
   50    47    53    60   0.08550 -1.0 2.0
   50    47    53    60   0.09800  1.0 3.0
   51    50    59    39   0.37050  1.0 3.0
   52    50    59    39   0.37050  1.0 3.0
   59    39    43    44   0.00000  1.0 1.0
   59    39   -43    47   0.39000  1.0 1.0
   59    39   -43    47  -0.05800 -1.0 2.0
   59    39   -43    47  -0.55150  1.0 3.0
   53    47    50    51   0.34800  1.0 3.0
   53    47    50    52   0.34800  1.0 3.0
   53    47    50    59   0.09700  1.0 1.0
   53    47    50    59   0.15600 -1.0 2.0
   53    47    50    59  -0.50800  1.0 3.0
   53    60    63    64   0.00000  1.0 1.0
   53    60    63    65   0.09850  1.0 1.0
   53    60    63    65   0.15250 -1.0 2.0
   53    60    63    65  -0.50650  1.0 3.0
   54    53    60    61   0.15000  1.0 3.0
   54    53    60    62   0.15000  1.0 3.0
   54    53    60    63   0.15000  1.0 3.0
   55    53    60    61   0.15000  1.0 3.0
   55    53    60    62   0.15000  1.0 3.0
   55    53    60    63   0.15000  1.0 3.0
   60    63    65    66   7.00000 -1.0 2.0
   60    63    65    70   7.00000 -1.0 2.0
   61    60    63    64   0.33100  1.0 3.0
   61    60    63    65   0.00000  1.0 1.0
   62    60    63    64   0.33100  1.0 3.0
   62    60    63    65   0.00000  1.0 1.0
   63    65    66    67   0.00000  1.0 1.0
   63    65    66    68   0.00000  1.0 1.0
   63    65    66    69   0.00000  1.0 1.0
   63    65    70    71   0.00000  1.0 1.0
   63    65    70    72   0.00000  1.0 1.0
   63    65    70    73   0.00000  1.0 1.0
   64    63    65    66   7.00000 -1.0 2.0
   64    63    65    70   7.00000 -1.0 2.0
   66    65    70    71   0.34800  1.0 3.0
   66    65    70    72   0.34800  1.0 3.0
   66    65    70    73   0.34800  1.0 3.0
   70    65    66    67   0.34800  1.0 3.0
   70    65    66    68   0.34800  1.0 3.0
   70    65    66    69   0.34800  1.0 3.0
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
   36    30    34    35  10.50000 -1.0 2.0
   33    41    37    38  10.50000 -1.0 2.0
   37    42    41    45   1.10000 -1.0 2.0
   48    46    45    41   1.10000 -1.0 2.0
   45    56    48    49  10.50000 -1.0 2.0
   39    44    43    47   1.10000 -1.0 2.0
   50    53    47    43   1.10000 -1.0 2.0
   60    64    63    65  15.00000 -1.0 2.0
   66    70    65    63  15.00000 -1.0 2.0
END
