* LIGAND DATABASE FILE (OPLS2005)
*
001      68    69    119    185     348
    1     0 S   NP   _N1_     1    28.69492    96.48570   -21.44330
    2     1 S   H    _HN1     2     1.02962    77.99095    30.87553
    3     1 S   H    _H1_     3     1.02832    40.94404   165.32993
    4     1 S   H    _H2_     4     1.02772    90.86257   -77.73938
    5     1 S   CT   _CA1     5     1.50159   149.85659   140.82616
    6     5 S   HC   _HA1     6     1.09576   105.16399    75.89992
    7     5 S   CO3  _C1_     7     1.53744   112.53109   -44.13993
    8     7 S   O2Z  _O11     8     1.26348   114.97463   -38.49748
    9     7 S   O2Z  _O12     9     1.26249   114.96817   140.56942
   10     5 S   CT   _CB1    10     1.53095   107.40509  -166.18976
   11    10 S   HC   HB11    11     1.09824   109.18412   -50.29223
   12    10 S   HC   HB12    12     1.09820   110.42953    66.23039
   13    10 S   CT   _CG1    13     1.53019   112.79197  -171.42909
   14    13 S   HC   HG11    14     1.09606   110.41928   -67.09276
   15    13 S   HC   HG12    15     1.09661   109.96022    52.15506
   16    13 S   C    _CD1    16     1.51850   112.37145   172.42182
   17    16 S   O    _OE1    17     1.22724   123.27839     0.51510
   18    16 S   N    _N2_    18     1.38636   111.62916  -179.31215
   19    18 S   H    _HN2    19     1.01586   118.98307     0.50668
   20    18 S   CT1  _CA2    20     1.46236   123.42435   179.79729
   21    20 S   HC   _HA2    21     1.09734   109.38475    -9.98940
   22    20 S   C    _C2_    22     1.53451   108.44862  -125.64303
   23    22 S   O    _O2_    23     1.23031   122.17495  -146.42121
   24    20 S   CT   _CB2    32     1.53369   111.45166   112.14144
   25    24 S   HC   HB21    33     1.09588   109.71391    54.98193
   26    24 S   HC   HB22    34     1.09477   110.38478   174.00848
   27    22 S   N    _N3_    24     1.38484   113.43060    40.97008
   28    27 S   H    _HN3    25     1.01522   118.91358    -0.74072
   29    24 S   S    _SG2    35     1.82677   111.60495   -66.13169
   30    27 S   CT   _CA3    26     1.45457   123.53881   175.11404
   31    30 S   HC   HA31    27     1.09516   109.35611    22.14218
   32    30 S   HC   HA32    28     1.09499   107.09703   139.16426
   33    29 S   CT   _C12    36     1.85359    99.62458   165.88915
   34    33 S   HC   _H4_    37     1.09640   106.04326   -43.34515
   35    30 S   CO3  _C3_    29     1.52915   113.01336  -101.41502
   36    35 S   O2Z  _O31    30     1.26409   115.36124   -45.47490
   37    35 S   O2Z  _O32    31     1.26347   115.00991   135.43038
   38    33 S   CA   _C13    38     1.52310   109.86058    74.09639
   39    33 S   CT   _C11    49     1.55306   110.31765  -160.83230
   40    39 S   HC   _H3_    50     1.09973   108.43776   -62.37472
   41    38 S   CA   _C14    39     1.40092   119.59572  -112.54593
   42    41 S   HA   _H12    40     1.08639   120.91785     0.11364
   43    39 S   CA   _C8_    51     1.52465   114.41962    58.59654
   44    39 S   CO3  _C18    66     1.54816   112.87440   179.92867
   45    44 S   O2Z  _O35    67     1.26367   116.27884   -34.60724
   46    44 S   O2Z  _O34    68     1.26551   114.56612   144.73800
   47    41 S   CA   _C15    41     1.38823   119.58991  -179.33265
   48    47 S   HA   _H13    42     1.08184   123.64091   179.70725
   49    43 S   CA   _C7_    52     1.40164   119.62359  -126.05234
   50    49 S   HA   _H9_    53     1.08729   120.43893    -0.50899
   51    47 S   NAP  _N4_    43     1.33890   120.09292    -0.13706
   52    51 S   H    _H14    44     1.01964   118.85531   179.85463
   53    49 S   CA   _C6_    54     1.39679   120.68097   179.24308
   54    53 S   HA   _H8_    55     1.08732   119.23351  -179.76261
   55    51 S   CA   _C16    45     1.33896   122.28384    -0.03426
   56    55 S   HA   _H15    46     1.08187   116.24689  -179.97202
   57    53 S   CA   _C5_    56     1.39707   120.64581     0.18871
   58    38 S   CA   _C17    47     1.40088   122.03890    67.86078
   59    58 S   HA   _H16    48     1.08600   121.19372    -0.63766
   60    57 S   CA   _C10    57     1.39507   119.13667     0.22985
   61    60 S   HA   _H11    58     1.08541   121.91964   179.62413
   62    57 S   OS   _O33    61     1.36905   114.97142   179.97202
   63    43 S   CA   _C9_    59     1.40281   122.07424    53.78378
   64    63 S   HA   _H10    60     1.08726   120.51736     0.97558
   65    62 S   CT   _C4_    62     1.42270   116.74758   178.57152
   66    65 S   HC   _H5_    63     1.09423   107.78399  -177.74380
   67    65 S   HC   _H6_    64     1.09497   110.95973    64.49709
   68    65 S   HC   _H7_    65     1.09454   111.32995   -59.81994
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  16   7   2   1   1  13  13   6   8   4  12   4   1   1   6   3
   8   4   5   3   7   3   3   2   9   1   1   5   3   5   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    58    39    40    43    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    47    55    58    59    39    40    43    49    63    44    45    46  
   38    41    58    39    40    43    44  
   36    37  
   37  
    0  
   41    42    47    48    51    55    56    58    59    39    40    43    44  
   40    43    49    50    53    60    63    64    44    45    46    41    58  
   43    49    63    44    45    46  
   42    47    48    51    52    55    58    59  
   47    48    51    58  
   49    50    53    54    57    60    61    63    64    44    45    46  
   45    46    49    63  
   46  
    0  
   48    51    52    55    56    58  
   51    52    55  
   50    53    54    57    60    63    64    62  
   53    54    57    63  
   52    55    56    58    59  
   55    56    58  
   54    57    60    61    63    62    65  
   57    60    62  
   56    58    59  
   58    59  
   60    61    63    64    62    65    66    67    68  
   59  
    0  
   61    63    64    62    65  
   63    64    62  
   65    66    67    68    63  
   64  
    0  
   66    67    68  
   67    68  
   68  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700   0.202200   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.045000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.5500   0.0700  -0.240800   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.205100   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   3.5500   0.0700   0.132600   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.182700   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.2500   0.1700  -0.244500   1.9750   1.7500   0.001000000  -0.511443539
   52   0.0000   0.0000   0.368100   0.9960   0.8600   0.030040813  -0.651083722
   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   3.5500   0.0700   0.132600   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.182700   1.3810   1.2100   0.030040813   0.268726247
   57   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.5500   0.0700  -0.240800   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.205100   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.030000   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    58   469.000  1.400
   41    42   367.000  1.080
   41    47   469.000  1.400
   47    48   367.000  1.080
   47    51   485.000  1.342
   51    52   475.000  1.020
   51    55   485.000  1.342
   55    56   367.000  1.080
   55    58   469.000  1.400
   58    59   367.000  1.080
   39    40   340.000  1.090
   39    43   317.000  1.510
   39    44   317.000  1.522
   43    49   469.000  1.400
   43    63   469.000  1.400
   49    50   367.000  1.080
   49    53   469.000  1.400
   53    54   367.000  1.080
   53    57   469.000  1.400
   57    60   469.000  1.400
   57    62   450.000  1.364
   60    61   367.000  1.080
   60    63   469.000  1.400
   63    64   367.000  1.080
   62    65   320.000  1.410
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   44    45   656.000  1.250
   44    46   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    58    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    70.00000  112.17500
   33    39    44    70.00000  109.69300
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    47    63.00000  120.00000
   38    58    55    63.00000  120.00000
   38    58    59    35.00000  120.00000
   41    47    48    35.00000  120.00000
   41    47    51    70.00000  119.29800
   47    41    42    35.00000  120.00000
   47    51    52    45.00000  117.56800
   47    51    55    70.00000  123.81700
   51    47    48    45.00000  112.84900
   51    55    56    45.00000  112.84900
   51    55    58    70.00000  119.29800
   55    51    52    45.00000  117.56800
   55    58    59    35.00000  120.00000
   58    38    41    63.00000  120.00000
   58    55    56    35.00000  120.00000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    49    70.00000  120.00000
   39    43    63    70.00000  120.00000
   39    44    45    70.00000  117.00000
   39    44    46    70.00000  117.00000
   43    39    40    35.00000  109.50000
   43    49    50    35.00000  120.00000
   43    49    53    63.00000  120.00000
   43    63    60    63.00000  120.00000
   43    63    64    35.00000  120.00000
   49    53    54    35.00000  120.00000
   49    53    57    63.00000  120.00000
   53    49    50    35.00000  120.00000
   53    57    60    63.00000  120.00000
   53    57    62    70.00000  120.00000
   57    53    54    35.00000  120.00000
   57    60    61    35.00000  120.00000
   57    60    63    63.00000  120.00000
   57    62    65    75.00000  111.00000
   60    63    64    35.00000  120.00000
   63    43    49    63.00000  120.00000
   63    60    61    35.00000  120.00000
   62    57    60    70.00000  120.00000
   62    65    66    35.00000  109.50000
   62    65    67    35.00000  109.50000
   62    65    68    35.00000  109.50000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    43    70.00000  106.62600
   46    44    45    80.00000  126.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    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    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    58  -0.16000  1.0 1.0
   29    33    38    58  -0.03200 -1.0 2.0
   29    33    38    58   0.04500  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    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    47   3.62500 -1.0 2.0
   33    38    58    55   3.62500 -1.0 2.0
   33    38    58    59   3.62500 -1.0 2.0
   33    39    43    49   0.04150 -1.0 2.0
   33    39    43    63   0.04150 -1.0 2.0
   33    39    44    45   0.41150 -1.0 2.0
   33    39    44    46   0.41150 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    58   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43   0.43200  1.0 3.0
   34    33    39    44  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    43  -0.94300  1.0 1.0
   38    33    39    43   1.32550 -1.0 2.0
   38    33    39    43  -0.07100  1.0 3.0
   38    33    39    44  -2.95950  1.0 1.0
   38    33    39    44   0.02300  1.0 3.0
   38    41    47    48   3.62500 -1.0 2.0
   38    41    47    51   3.62500 -1.0 2.0
   41    38    58    55   3.62500 -1.0 2.0
   41    38    58    59   3.62500 -1.0 2.0
   41    47    51    52   3.62500 -1.0 2.0
   41    47   -51    55   3.62500 -1.0 2.0
   42    41    47    48   3.62500 -1.0 2.0
   42    41    47    51   3.62500 -1.0 2.0
   47    51    55    56   3.62500 -1.0 2.0
   47    51    55    58   3.62500 -1.0 2.0
   48    47    51    52   3.62500 -1.0 2.0
   48    47    51    55   3.62500 -1.0 2.0
   51    55   -58    38   3.62500 -1.0 2.0
   51    55    58    59   3.62500 -1.0 2.0
   52    51    55    56   3.62500 -1.0 2.0
   52    51    55    58   3.62500 -1.0 2.0
   56    55    58    38   3.62500 -1.0 2.0
   56    55    58    59   3.62500 -1.0 2.0
   58    38    41    42   3.62500 -1.0 2.0
   58    38   -41    47   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    58   0.04150 -1.0 2.0
   39    43    49    50   3.62500 -1.0 2.0
   39    43    49    53   3.62500 -1.0 2.0
   39    43    63    60   3.62500 -1.0 2.0
   39    43    63    64   3.62500 -1.0 2.0
   40    39    43    49   0.00000  1.0 1.0
   40    39    43    63   0.00000  1.0 1.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    46   0.00000  1.0 1.0
   43    39    44    45   0.30150 -1.0 2.0
   43    39    44    46   0.30150 -1.0 2.0
   43    49    53    54   3.62500 -1.0 2.0
   43    49    53    57   3.62500 -1.0 2.0
   49    43    63    60   3.62500 -1.0 2.0
   49    43    63    64   3.62500 -1.0 2.0
   49    53   -57    60   3.62500 -1.0 2.0
   49    53    57    62   3.62500 -1.0 2.0
   50    49    53    54   3.62500 -1.0 2.0
   50    49    53    57   3.62500 -1.0 2.0
   53    57    60    61   3.62500 -1.0 2.0
   53    57    60    63   3.62500 -1.0 2.0
   53    57    62    65   1.63200 -1.0 2.0
   54    53    57    60   3.62500 -1.0 2.0
   54    53    57    62   3.62500 -1.0 2.0
   57    60   -63    43   3.62500 -1.0 2.0
   57    60    63    64   3.62500 -1.0 2.0
   57    62    65    66   0.08050  1.0 3.0
   57    62    65    67   0.08050  1.0 3.0
   57    62    65    68   0.08050  1.0 3.0
   60    57    62    65   1.63200 -1.0 2.0
   61    60    63    43   3.62500 -1.0 2.0
   61    60    63    64   3.62500 -1.0 2.0
   63    43    49    50   3.62500 -1.0 2.0
   63    43   -49    53   3.62500 -1.0 2.0
   62    57    60    61   3.62500 -1.0 2.0
   62    57    60    63   3.62500 -1.0 2.0
   44    39    43    49   0.04300 -1.0 2.0
   44    39    43    63   0.04300 -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
   36    30    35    37  10.50000 -1.0 2.0
   41    58    38    33   4.00000 -1.0 2.0
   47    42    41    38   1.10000 -1.0 2.0
   51    48    47    41   1.10000 -1.0 2.0
   52    47    51    55   1.00000 -1.0 2.0
   58    56    55    51   1.10000 -1.0 2.0
   55    59    58    38   1.10000 -1.0 2.0
   49    63    43    39   4.00000 -1.0 2.0
   53    50    49    43   1.10000 -1.0 2.0
   57    54    53    49   1.10000 -1.0 2.0
   60    62    57    53   4.00000 -1.0 2.0
   63    61    60    57   1.10000 -1.0 2.0
   60    64    63    43   1.10000 -1.0 2.0
   45    39    44    46  10.50000 -1.0 2.0
END
