* LIGAND DATABASE FILE (OPLS2005)
*
001      75    78    146    237     434
    1     0 S   NP   _N1_     1    28.82770    95.65455   -20.52007
    2     1 S   H    _HN1     2     1.02779    84.72051   -90.23301
    3     1 S   H    _H1_     3     1.02951    82.75847    19.08019
    4     1 S   H    _H2_     4     1.02829    41.59868   145.08721
    5     1 S   CT   _CA1     5     1.50120   152.23979   139.93300
    6     5 S   HC   _HA1     6     1.09565   105.22571    62.87244
    7     5 S   CO3  _C1_     7     1.53891   112.44412   -57.39682
    8     7 S   O2Z  _O11     8     1.26382   115.01215   -40.46096
    9     7 S   O2Z  _O12     9     1.26238   114.99969   138.72602
   10     5 S   CT   _CB1    10     1.53102   107.42113  -179.03126
   11    10 S   HC   HB11    11     1.09824   109.63482   -48.43793
   12    10 S   HC   HB12    12     1.09789   110.29431    68.16718
   13    10 S   CT   _CG1    13     1.52937   112.53627  -169.34469
   14    13 S   HC   HG11    14     1.09508   110.56676   -60.53983
   15    13 S   HC   HG12    15     1.09655   109.88483    58.58603
   16    13 S   C    _CD1    16     1.51755   112.45575   179.21491
   17    16 S   O    _OE1    17     1.22704   123.35622     0.38052
   18    16 S   N    _N2_    18     1.38611   111.46542  -179.81025
   19    18 S   H    _HN2    19     1.01585   118.92364     2.43759
   20    18 S   CT1  _CA2    20     1.46156   123.55194  -178.99751
   21    20 S   HC   _HA2    21     1.09730   109.37321    -6.43401
   22    20 S   C    _C2_    22     1.53396   108.56086  -122.03271
   23    22 S   O    _O2_    23     1.23039   122.33646  -148.68963
   24    20 S   CT   _CB2    32     1.53357   111.30715   115.58932
   25    24 S   HC   HB21    33     1.09472   110.06365    57.33258
   26    24 S   HC   HB22    34     1.09526   110.41156   175.29089
   27    22 S   N    _N3_    24     1.38357   113.54726    38.83154
   28    27 S   H    _HN3    25     1.01634   119.49736    -3.59918
   29    24 S   S    _SG2    35     1.83053   111.37128   -66.12371
   30    27 S   CT   _CA3    26     1.45284   123.12557   176.97179
   31    30 S   HC   HA31    27     1.09552   107.52016   -63.96570
   32    30 S   HC   HA32    28     1.09559   107.95067    52.43775
   33    29 S   CT   _C13    36     1.87968   100.84617   135.27880
   34    30 S   CO3  _C3_    29     1.52933   114.14928   174.42712
   35    34 S   O2Z  _O31    30     1.26365   116.06933    -0.77984
   36    34 S   O2Z  _O32    31     1.26431   114.40780   179.28263
   37    33 S   CT   _C14    37     1.56116   109.12569   -72.39973
   38    37 S   HC   _H16    38     1.09810   109.35803   153.39125
   39    37 S   HC   _H17    39     1.09580   110.44519    39.04316
   40    33 S   CT   _C9_    50     1.54521   112.87163   169.55616
   41    40 S   HC   _H5_    51     1.10274   106.24921  -171.96153
   42    37 S   CT   _C5_    40     1.55873   113.62085   -83.68247
   43    42 S   HC   _H3_    41     1.09584   108.73216   145.56284
   44    40 S   CO4  _C10    52     1.51424   108.45595   -63.33274
   45    44 S   O    _O33    53     1.22644   124.04004   128.00361
   46    42 S   CT   _C6_    42     1.54122   112.47896   -91.30184
   47    46 S   HC   _H10    43     1.09466   112.67322   -24.34317
   48    46 S   HC   _H11    44     1.09623   110.80885  -145.05573
   49    44 S   CT   _C11    54     1.51397   113.43124   -56.68688
   50    49 S   HC   _H14    55     1.09544   109.78766   170.82639
   51    49 S   HC   _H15    56     1.09672   106.56493   -72.72559
   52    46 S   CT   _C7_    45     1.53231   105.02579    97.00274
   53    52 S   HC   _H12    46     1.09663   110.06799   108.03213
   54    52 S   HC   _H13    47     1.09495   112.05817  -133.34880
   55    49 S   CT   _C12    57     1.53489   110.33232    48.60896
   56    55 S   HC   _H6_    58     1.09574   108.84630    74.54232
   57    52 S   CT   _C8_    48     1.53546   103.34672   -10.56479
   58    57 S   HC   _H4_    49     1.09416   111.97891   156.90465
   59    55 S   CA   _C15    59     1.51551   110.69084  -167.27719
   60    33 S   OS   _O34    70     1.44272   111.40132    47.98956
   61    59 S   CA   _C16    60     1.40265   120.11771  -102.25809
   62    61 S   HA   _H18    61     1.08736   120.46594    -0.56406
   63    42 S   NT   _N4_    71     1.47011   107.42577    22.20577
   64    61 S   CA   _C17    62     1.39616   120.57328   179.43872
   65    64 S   HA   _H19    63     1.08633   119.92575   179.87333
   66    63 S   CT   _C4_    72     1.45760   113.66314   158.50658
   67    66 S   HC   _H7_    73     1.09533   110.23392   176.26697
   68    66 S   HC   _H8_    74     1.09430   114.25718    54.12865
   69    66 S   HC   _H9_    75     1.09459   109.56015   -66.76024
   70    64 S   CA   _C18    64     1.39332   120.10577    -0.17694
   71    70 S   HA   _H20    65     1.08614   120.03607  -179.97202
   72    70 S   CA   _C19    66     1.39317   119.92373    -0.07133
   73    72 S   HA   _H21    67     1.08626   119.99393  -179.88465
   74    59 S   CA   _C20    68     1.40362   121.15157    76.74540
   75    74 S   HA   _H22    69     1.08739   120.34627     0.58717
  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  11   5   4   3
  19   2   1   1  16   7   6  17   8  15   7  12   5   9   6   5
   9   5   4   6   4   3   9   4   7   2  10   2   8   4   4   6
   3   3   2   1   1   5   3   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    40    60    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    42    57    40    41    44    55    60  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    43    46    52    57    58    40    41    44    45    49    55    56    59    60    63  
   35    36  
   36  
    0  
   38    39    42    43    46    47    48    52    57    40    41    44    55    60    63    66  
   39    42    43    46    40    60    63  
   42    43    46    40    60    63  
   41    44    45    49    50    51    55    60    63    66    42    46    52    53    54    57    58  
   44    45    49    60    63    52    57    58  
   43    46    47    48    52    53    54    57    58    60    63    66    67    68    69  
   46    47    48    52    57    63    66  
   45    49    50    51    55    56    59    60    63    52    57    58  
   49    50    51    55    57  
   47    48    52    53    54    57    58    63    66  
   48    52    53    54    57    63  
   52    53    54    57    63  
   50    51    55    56    59    61    74    60    57  
   51    55    56    59    60  
   55    56    59    60  
   53    54    57    58    63    66  
   54    57    58    63  
   57    58    63  
   56    59    61    62    64    72    74    75    60  
   59    61    74    60  
   58    60    63    66    67    68    69  
   63    66  
   61    62    64    65    70    72    73    74    75    60  
   61    74  
   62    64    65    70    71    72    74    75  
   64    65    70    74  
   66    67    68    69  
   65    70    71    72    73    74  
   70    71    72  
   67    68    69  
   68    69  
   69  
    0  
   71    72    73    74    75  
   72    73    74  
   73    74    75  
   74    75  
   75  
    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  -0.316400   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   0.348900   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.211800   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0700  -0.041800   2.5000   1.7750   0.001000000  -0.843144165
   60   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   64   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   66   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   72   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   73   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   74   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   75   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   268.000  1.529
   33    40   268.000  1.529
   33    60   320.000  1.410
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    42   268.000  1.529
   42    43   340.000  1.090
   42    46   268.000  1.529
   42    63   382.000  1.448
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    57   268.000  1.529
   57    58   340.000  1.090
   57    40   268.000  1.529
   57    63   382.000  1.448
   40    41   340.000  1.090
   40    44   317.000  1.522
   44    45   570.000  1.229
   44    49   317.000  1.522
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    55   268.000  1.529
   55    56   340.000  1.090
   55    59   317.000  1.510
   55    60   320.000  1.410
   59    61   469.000  1.400
   59    74   469.000  1.400
   61    62   367.000  1.080
   61    64   469.000  1.400
   64    65   367.000  1.080
   64    70   469.000  1.400
   70    71   367.000  1.080
   70    72   469.000  1.400
   72    73   367.000  1.080
   72    74   469.000  1.400
   74    75   367.000  1.080
   63    66   382.000  1.448
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   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  111.63000
   29    33    40    75.00000  111.63000
   29    33    60    85.00000  114.68000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    42    58.35000  112.70000
   33    40    57    58.35000  112.70000
   33    40    41    37.50000  110.70000
   33    40    44    63.00000  111.10000
   33    60    55    60.00000  109.50000
   37    42    43    37.50000  110.70000
   37    42    46    58.35000  112.70000
   37    42    63    56.20000  109.47000
   39    37    38    33.00000  107.80000
   42    37    38    37.50000  110.70000
   42    37    39    37.50000  110.70000
   42    46    47    37.50000  110.70000
   42    46    48    37.50000  110.70000
   42    46    52    58.35000  112.70000
   42    63    57    51.80000  107.20000
   42    63    66    51.80000  107.20000
   46    42    43    37.50000  110.70000
   46    52    53    37.50000  110.70000
   46    52    54    37.50000  110.70000
   46    52    57    58.35000  112.70000
   48    46    47    33.00000  107.80000
   52    46    47    37.50000  110.70000
   52    46    48    37.50000  110.70000
   52    57    58    37.50000  110.70000
   52    57    40    58.35000  112.70000
   52    57    63    56.20000  109.47000
   54    52    53    33.00000  107.80000
   57    52    53    37.50000  110.70000
   57    52    54    37.50000  110.70000
   57    40    41    37.50000  110.70000
   57    40    44    63.00000  111.10000
   57    63    66    51.80000  107.20000
   40    33    37    58.35000  112.70000
   40    57    58    37.50000  110.70000
   40    44    45    80.00000  120.40000
   40    44    49    70.00000  116.00000
   44    40    41    35.00000  109.50000
   44    49    50    35.00000  109.50000
   44    49    51    35.00000  109.50000
   44    49    55    63.00000  111.10000
   49    44    45    80.00000  120.40000
   49    55    56    37.50000  110.70000
   49    55    59    70.00000  112.17500
   49    55    60    50.00000  109.50000
   51    49    50    33.00000  107.80000
   55    49    50    37.50000  110.70000
   55    49    51    37.50000  110.70000
   55    59    61    70.00000  120.00000
   55    59    74    70.00000  120.00000
   59    55    56    35.00000  109.50000
   59    61    62    35.00000  120.00000
   59    61    64    63.00000  120.00000
   59    74    72    63.00000  120.00000
   59    74    75    35.00000  120.00000
   61    64    65    35.00000  120.00000
   61    64    70    63.00000  120.00000
   64    61    62    35.00000  120.00000
   64    70    71    35.00000  120.00000
   64    70    72    63.00000  120.00000
   70    64    65    35.00000  120.00000
   70    72    73    35.00000  120.00000
   70    72    74    63.00000  120.00000
   72    70    71    35.00000  120.00000
   72    74    75    35.00000  120.00000
   74    59    61    63.00000  120.00000
   74    72    73    35.00000  120.00000
   60    33    37    50.00000  109.50000
   60    33    40    50.00000  109.50000
   60    55    56    35.00000  109.50000
   60    55    59    85.00000  111.85700
   63    42    43    35.00000  109.50000
   63    42    46    56.20000  109.47000
   63    57    58    35.00000  109.50000
   63    57    40    56.20000  109.47000
   63    66    67    35.00000  109.50000
   63    66    68    35.00000  109.50000
   63    66    69    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
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    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   24    29    33    60   0.13850  1.0 1.0
   24    29    33    60  -1.34450 -1.0 2.0
   24    29    33    60   0.57400  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   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    42   0.44750  1.0 1.0
   29    33    37    42  -0.17800 -1.0 2.0
   29    33    37    42   0.20200  1.0 3.0
   29    33    40    57   0.44750  1.0 1.0
   29    33    40    57  -0.17800 -1.0 2.0
   29    33    40    57   0.20200  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    44   0.56750  1.0 1.0
   29    33    40    44  -0.07550 -1.0 2.0
   29    33    40    44   0.20000  1.0 3.0
   29    33    60    55   0.14700  1.0 1.0
   29    33    60    55  -1.16150 -1.0 2.0
   29    33    60    55   0.48700  1.0 3.0
   33    37    42    43   0.15000  1.0 3.0
   33    37    42    46   0.56750  1.0 1.0
   33    37    42    46  -0.07550 -1.0 2.0
   33    37    42    46   0.20000  1.0 3.0
   33    37    42    63   1.53400  1.0 1.0
   33    37    42    63  -0.09950 -1.0 2.0
   33    37    42    63   0.05700  1.0 3.0
   33    40    44    45   0.30150 -1.0 2.0
   33    40    44    49   0.60050  1.0 1.0
   33    40    44    49   0.05600 -1.0 2.0
   33    40    44    49   0.26150  1.0 3.0
   37    33    40    57   0.56750  1.0 1.0
   37    33    40    57  -0.07550 -1.0 2.0
   37    33    40    57   0.20000  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    44  -0.95700  1.0 1.0
   37    33    40    44  -0.18200 -1.0 2.0
   37    33    40    44   0.29450  1.0 3.0
   37    33    60    55   0.06250  1.0 1.0
   37    33    60    55  -0.01100 -1.0 2.0
   37    33    60    55   0.28050  1.0 3.0
   37    42    46    47   0.15000  1.0 3.0
   37    42    46    48   0.15000  1.0 3.0
   37    42    46    52   0.56750  1.0 1.0
   37    42    46    52  -0.07550 -1.0 2.0
   37    42    46    52   0.20000  1.0 3.0
   37    42   -63    57   0.23450  1.0 1.0
   37    42   -63    57   0.02050 -1.0 2.0
   37    42   -63    57   0.25250  1.0 3.0
   37    42    63    66   0.58650  1.0 1.0
   37    42    63    66   0.12600 -1.0 2.0
   37    42    63    66   0.33350  1.0 3.0
   38    37    42    43   0.15000  1.0 3.0
   38    37    42    46   0.15000  1.0 3.0
   38    37    42    63   0.15000  1.0 3.0
   39    37    42    43   0.15000  1.0 3.0
   39    37    42    46   0.15000  1.0 3.0
   39    37    42    63   0.15000  1.0 3.0
   42    46    52    53   0.15000  1.0 3.0
   42    46    52    54   0.15000  1.0 3.0
   42    46   -52    57   0.56750  1.0 1.0
   42    46   -52    57  -0.07550 -1.0 2.0
   42    46   -52    57   0.20000  1.0 3.0
   42    63    66    67   0.28000  1.0 3.0
   42    63    66    68   0.28000  1.0 3.0
   42    63    66    69   0.28000  1.0 3.0
   43    42    46    47   0.15000  1.0 3.0
   43    42    46    48   0.15000  1.0 3.0
   43    42    46    52   0.15000  1.0 3.0
   43    42    63    57   0.28000  1.0 3.0
   43    42    63    66   0.28000  1.0 3.0
   46    42   -63    57   0.23450  1.0 1.0
   46    42   -63    57   0.02050 -1.0 2.0
   46    42   -63    57   0.25250  1.0 3.0
   46    42    63    66   0.58650  1.0 1.0
   46    42    63    66   0.12600 -1.0 2.0
   46    42    63    66   0.33350  1.0 3.0
   46    52    57    58   0.15000  1.0 3.0
   46    52    57    40   0.56750  1.0 1.0
   46    52    57    40  -0.07550 -1.0 2.0
   46    52    57    40   0.20000  1.0 3.0
   46    52   -57    63   1.53400  1.0 1.0
   46    52   -57    63  -0.09950 -1.0 2.0
   46    52   -57    63   0.05700  1.0 3.0
   47    46    52    53   0.15000  1.0 3.0
   47    46    52    54   0.15000  1.0 3.0
   47    46    52    57   0.15000  1.0 3.0
   48    46    52    53   0.15000  1.0 3.0
   48    46    52    54   0.15000  1.0 3.0
   48    46    52    57   0.15000  1.0 3.0
   52    57    40    33   0.56750  1.0 1.0
   52    57    40    33  -0.07550 -1.0 2.0
   52    57    40    33   0.20000  1.0 3.0
   52    57    40    41   0.15000  1.0 3.0
   52    57    40    44  -0.95700  1.0 1.0
   52    57    40    44  -0.18200 -1.0 2.0
   52    57    40    44   0.29450  1.0 3.0
   52    57   -63    42   0.23450  1.0 1.0
   52    57   -63    42   0.02050 -1.0 2.0
   52    57   -63    42   0.25250  1.0 3.0
   52    57    63    66   0.58650  1.0 1.0
   52    57    63    66   0.12600 -1.0 2.0
   52    57    63    66   0.33350  1.0 3.0
   53    52    57    58   0.15000  1.0 3.0
   53    52    57    40   0.15000  1.0 3.0
   53    52    57    63   0.15000  1.0 3.0
   54    52    57    58   0.15000  1.0 3.0
   54    52    57    40   0.15000  1.0 3.0
   54    52    57    63   0.15000  1.0 3.0
   57    40    44    45   0.30150 -1.0 2.0
   57    40    44    49   0.60050  1.0 1.0
   57    40    44    49   0.05600 -1.0 2.0
   57    40    44    49   0.26150  1.0 3.0
   57    63    66    67   0.28000  1.0 3.0
   57    63    66    68   0.28000  1.0 3.0
   57    63    66    69   0.28000  1.0 3.0
   58    57    40    33   0.15000  1.0 3.0
   58    57    40    41   0.15000  1.0 3.0
   58    57    40    44  -0.11250  1.0 3.0
   58    57    63    42   0.28000  1.0 3.0
   58    57    63    66   0.28000  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    42   0.56750  1.0 1.0
   40    33    37    42  -0.07550 -1.0 2.0
   40    33    37    42   0.20000  1.0 3.0
   40    33    60    55   0.06250  1.0 1.0
   40    33    60    55  -0.01100 -1.0 2.0
   40    33    60    55   0.28050  1.0 3.0
   40    57   -63    42   0.23450  1.0 1.0
   40    57   -63    42   0.02050 -1.0 2.0
   40    57   -63    42   0.25250  1.0 3.0
   40    57    63    66   0.58650  1.0 1.0
   40    57    63    66   0.12600 -1.0 2.0
   40    57    63    66   0.33350  1.0 3.0
   40    44    49    50   0.00000  1.0 1.0
   40    44    49    51   0.00000  1.0 1.0
   40    44   -49    55   0.60050  1.0 1.0
   40    44   -49    55   0.05600 -1.0 2.0
   40    44   -49    55   0.26150  1.0 3.0
   41    40    44    45   0.00000  1.0 1.0
   41    40    44    49   0.00000  1.0 1.0
   44    49    55    56  -0.11250  1.0 3.0
   44    49    55    59   0.56750  1.0 1.0
   44    49    55    59  -0.07550 -1.0 2.0
   44    49    55    59   0.20000  1.0 3.0
   44    49    55    60  -0.09450  1.0 1.0
   44    49    55    60  -1.12950 -1.0 2.0
   44    49    55    60   0.54000  1.0 3.0
   45    44    49    50   0.00000  1.0 1.0
   45    44    49    51   0.00000  1.0 1.0
   45    44    49    55   0.30150 -1.0 2.0
   49    55    59    61   0.04150 -1.0 2.0
   49    55    59    74   0.04150 -1.0 2.0
   49    55   -60    33   0.06250  1.0 1.0
   49    55   -60    33  -0.01100 -1.0 2.0
   49    55   -60    33   0.28050  1.0 3.0
   50    49    55    56   0.15000  1.0 3.0
   50    49    55    59   0.43200  1.0 3.0
   50    49    55    60   0.23400  1.0 3.0
   51    49    55    56   0.15000  1.0 3.0
   51    49    55    59   0.43200  1.0 3.0
   51    49    55    60   0.23400  1.0 3.0
   55    59    61    62   3.62500 -1.0 2.0
   55    59    61    64   3.62500 -1.0 2.0
   55    59    74    72   3.62500 -1.0 2.0
   55    59    74    75   3.62500 -1.0 2.0
   56    55    59    61   0.00000  1.0 1.0
   56    55    59    74   0.00000  1.0 1.0
   56    55    60    33   0.37050  1.0 3.0
   59    55    60    33   0.37500  1.0 3.0
   59    61    64    65   3.62500 -1.0 2.0
   59    61    64    70   3.62500 -1.0 2.0
   61    59    74    72   3.62500 -1.0 2.0
   61    59    74    75   3.62500 -1.0 2.0
   61    64    70    71   3.62500 -1.0 2.0
   61    64   -70    72   3.62500 -1.0 2.0
   62    61    64    65   3.62500 -1.0 2.0
   62    61    64    70   3.62500 -1.0 2.0
   64    70    72    73   3.62500 -1.0 2.0
   64    70    72    74   3.62500 -1.0 2.0
   65    64    70    71   3.62500 -1.0 2.0
   65    64    70    72   3.62500 -1.0 2.0
   70    72   -74    59   3.62500 -1.0 2.0
   70    72    74    75   3.62500 -1.0 2.0
   71    70    72    73   3.62500 -1.0 2.0
   71    70    72    74   3.62500 -1.0 2.0
   73    72    74    59   3.62500 -1.0 2.0
   73    72    74    75   3.62500 -1.0 2.0
   74    59    61    62   3.62500 -1.0 2.0
   74    59   -61    64   3.62500 -1.0 2.0
   60    33    37    38   0.23400  1.0 3.0
   60    33    37    39   0.23400  1.0 3.0
   60    33    37    42   0.62750  1.0 1.0
   60    33    37    42  -0.30950 -1.0 2.0
   60    33    37    42   0.27300  1.0 3.0
   60    33    40    57   0.62750  1.0 1.0
   60    33    40    57  -0.30950 -1.0 2.0
   60    33    40    57   0.27300  1.0 3.0
   60    33    40    41   0.23400  1.0 3.0
   60    33   -40    44  -0.09450  1.0 1.0
   60    33   -40    44  -1.12950 -1.0 2.0
   60    33   -40    44   0.54000  1.0 3.0
   60    55    59    61   0.64500  1.0 1.0
   60    55    59    61   0.14800 -1.0 2.0
   60    55    59    61   0.20650  1.0 3.0
   60    55    59    74   0.64500  1.0 1.0
   60    55    59    74   0.14800 -1.0 2.0
   60    55    59    74   0.20650  1.0 3.0
   63    42    46    47   0.15000  1.0 3.0
   63    42    46    48   0.15000  1.0 3.0
   63    42   -46    52   1.53400  1.0 1.0
   63    42   -46    52  -0.09950 -1.0 2.0
   63    42   -46    52   0.05700  1.0 3.0
   63    57   -40    33   1.53400  1.0 1.0
   63    57   -40    33  -0.09950 -1.0 2.0
   63    57   -40    33   0.05700  1.0 3.0
   63    57    40    41   0.15000  1.0 3.0
   63    57    40    44  -3.56550  1.0 1.0
   63    57    40    44  -0.67500 -1.0 2.0
   63    57    40    44   1.11300  1.0 3.0
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    49    44    45  10.50000 -1.0 2.0
   61    74    59    55   4.00000 -1.0 2.0
   64    62    61    59   1.10000 -1.0 2.0
   70    65    64    61   1.10000 -1.0 2.0
   72    71    70    64   1.10000 -1.0 2.0
   74    73    72    70   1.10000 -1.0 2.0
   72    75    74    59   1.10000 -1.0 2.0
END
