* LIGAND DATABASE FILE (OPLS2005)
*
001      70    72    129    206     382
    1     0 S   NP   _N1_     1    28.85119    95.15817   -25.03328
    2     1 S   H    _HN1     2     1.02786   114.40891   -89.81769
    3     1 S   H    _H1_     3     1.02950    77.68244    14.95534
    4     1 S   H    _H2_     4     1.02827    29.70071  -173.23966
    5     1 S   CT   _CA1     5     1.50112   126.71922   121.33880
    6     5 S   HC   _HA1     6     1.09574   105.19465    88.02158
    7     5 S   CO3  _C1_     7     1.53784   112.46065   -32.19938
    8     7 S   O2Z  _O11     8     1.26369   115.00725   -42.77394
    9     7 S   O2Z  _O12     9     1.26241   114.94002   136.34994
   10     5 S   CT   _CB1    10     1.53077   107.41338  -154.02262
   11    10 S   HC   HB11    11     1.09833   109.34375   -49.98124
   12    10 S   HC   HB12    12     1.09813   110.46069    66.61862
   13    10 S   CT   _CG1    13     1.52984   112.61002  -170.97444
   14    13 S   HC   HG11    14     1.09584   110.61333   -65.85695
   15    13 S   HC   HG12    15     1.09672   109.79903    53.37222
   16    13 S   C    _CD1    16     1.51800   112.23987   173.79300
   17    16 S   O    _OE1    17     1.22729   123.29505     6.23920
   18    16 S   N    _N2_    18     1.38649   111.65143  -173.74712
   19    18 S   H    _HN2    19     1.01576   118.93365     1.66154
   20    18 S   CT1  _CA2    20     1.46227   123.42241   177.48316
   21    20 S   HC   _HA2    21     1.09737   109.37777     3.14653
   22    20 S   C    _C2_    22     1.53573   108.52031  -112.31457
   23    22 S   O    _O2_    23     1.23050   122.34426  -147.45827
   24    20 S   CT   _CB2    32     1.53387   111.55372   125.19832
   25    24 S   HC   HB21    33     1.09435   109.75615    56.54516
   26    24 S   HC   HB22    34     1.09475   109.80910   175.45748
   27    22 S   N    _N3_    24     1.38350   113.69169    39.95786
   28    27 S   H    _HN3    25     1.01579   119.59294    -3.23658
   29    24 S   S    _SG2    35     1.82931   111.23094   -64.90339
   30    27 S   CT   _CA3    26     1.45283   123.20774   177.18694
   31    30 S   HC   HA31    27     1.09549   107.50292   -64.80747
   32    30 S   HC   HA32    28     1.09557   107.99520    51.63256
   33    29 S   CT   _C5_    36     1.85976   100.95919   175.80721
   34    30 S   CO3  _C3_    29     1.52958   114.08242   173.63628
   35    34 S   O2Z  _O31    30     1.26375   116.07626    -0.64133
   36    34 S   O2Z  _O32    31     1.26429   114.40955   179.41818
   37    33 S   CT   _C6_    37     1.56743   109.22821   163.03431
   38    37 S   HC   _H3_    38     1.10119   109.93552   -41.91606
   39    33 S   OS   _O35    60     1.44603   109.92735    39.35378
   40    33 S   CT   _C4_    67     1.53792   108.35454   -74.84335
   41    40 S   HC   _H5_    68     1.09559   111.77700    66.82878
   42    40 S   HC   _H6_    69     1.09482   112.96525   -55.57566
   43    40 S   HC   _H7_    70     1.09658   110.41195  -176.46376
   44    37 S   CO4  _C15    39     1.53578   113.66946    74.88273
   45    44 S   O    _O33    40     1.22997   121.14333   -61.00548
   46    44 S   CA   _C14    41     1.48951   119.89349   119.32281
   47    46 S   CA   _C9_    42     1.40159   119.08819     4.72808
   48    47 S   CA   _C10    43     1.40361   119.52509   179.80119
   49    48 S   HA   _H9_    44     1.08809   120.68664  -180.00000
   50    47 S   CM   _C8_    52     1.45908   121.63207    -0.15066
   51    50 S   HC   _H8_    53     1.08607   118.15693   178.65433
   52    48 S   CA   _C11    45     1.39425   120.67241     0.08156
   53    52 S   HA   _H10    46     1.08625   120.04033   179.94766
   54    37 S   CM   _C7_    54     1.50758   109.41561  -156.75211
   55    52 S   CA   _C12    47     1.39081   119.89176    -0.04423
   56    55 S   HA   _H11    48     1.08677   119.71183   180.00000
   57    54 S   CT   _C16    55     1.50890   114.90201    53.70900
   58    57 S   HC   _H13    56     1.09551   109.89267   108.40946
   59    57 S   HC   _H14    57     1.09776   108.52183  -133.80136
   60    46 S   CA   _C13    49     1.40495   121.59422  -175.43936
   61    57 S   CT   _C17    58     1.53607   110.85955   -13.45182
   62    61 S   HC   _H4_    59     1.09758   111.03468    73.92027
   63    60 S   OH   _O34    50     1.36910   123.55716     0.28116
   64    63 S   HO   _H12    51     0.97393   108.84635    -1.17170
   65    61 S   CT   _C18    61     1.52754   111.91923  -164.00067
   66    65 S   HC   _H15    62     1.09820   108.90251   171.71613
   67    65 S   HC   _H16    63     1.09806   109.62062    56.89868
   68    65 S   CO3  _C19    64     1.52945   116.03616   -67.52340
   69    68 S   O2Z  _O37    65     1.26158   116.31299   -22.40347
   70    68 S   O2Z  _O36    66     1.26437   114.31919   158.13253
  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
  16   2   1   1  18   8  15   6   2   1   1  10   4  12  11   9
   4   8   2   5   3   6   4   2   8   4   3   2   7   4   1   1
   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    54    61    39    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    44    45    46    50    54    57    61    62    39    65    40    41    42    43  
   35    36  
   36  
    0  
   38    44    45    46    47    60    50    51    54    57    58    59    61    39    40    41    42    43  
   44    45    46    50    54    57    39    40  
   65    66    67    68    40    41    42    43    44    54    57    58    59    61    62  
   41    42    43    44    54    61  
   42    43  
   43  
    0  
   45    46    47    48    55    60    63    50    54    57  
   46    47    60    54  
   47    48    49    52    55    56    60    63    64    50    51    54  
   48    49    52    53    55    60    63    50    51    54    57  
   49    52    53    55    56    60    50    51    54  
   52    53    55    50  
   51    54    57    58    59    61    52    60  
   54    57  
   53    55    56    60    63  
   55    56    60  
   57    58    59    61    62    65  
   56    60    63    64  
   60    63  
   58    59    61    62    65    66    67    68  
   59    61    62    65  
   61    62    65  
   63    64  
   62    65    66    67    68    69    70  
   65    66    67    68  
   64  
    0  
   66    67    68    69    70  
   67    68    69    70  
   68    69    70  
   69    70  
   70  
    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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   61   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   63   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   64   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   65   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   68   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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    39   320.000  1.410
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    44   317.000  1.522
   37    54   317.000  1.510
   44    45   570.000  1.229
   44    46   310.000  1.470
   46    47   469.000  1.400
   46    60   469.000  1.400
   47    48   469.000  1.400
   47    50   320.000  1.460
   48    49   367.000  1.080
   48    52   469.000  1.400
   52    53   367.000  1.080
   52    55   469.000  1.400
   55    56   367.000  1.080
   55    60   469.000  1.400
   60    63   450.000  1.364
   63    64   553.000  0.945
   50    51   340.000  1.080
   50    54   549.000  1.340
   54    57   317.000  1.510
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    61   268.000  1.529
   61    62   340.000  1.090
   61    39   320.000  1.410
   61    65   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   317.000  1.522
   68    69   656.000  1.250
   68    70   656.000  1.250
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   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    39    85.00000  114.68000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    44    63.00000  111.10000
   33    37    54    70.00000  112.02700
   33    39    61    60.00000  109.50000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    80.00000  120.40000
   37    44    46    65.00000  115.47100
   37    54    50    70.00000  124.00000
   37    54    57    65.00000  117.92700
   44    37    38    35.00000  109.50000
   44    46    47    60.00000  119.52600
   44    46    60    60.00000  119.52600
   46    44    45    75.00000  123.78400
   46    47    48    63.00000  120.00000
   46    47    50    60.00000  120.93500
   46    60    55    63.00000  120.00000
   46    60    63    70.00000  120.00000
   47    48    49    35.00000  120.00000
   47    48    52    63.00000  120.00000
   47    50    51    40.00000  117.26300
   47    50    54    60.00000  123.20500
   48    52    53    35.00000  120.00000
   48    52    55    63.00000  120.00000
   52    48    49    35.00000  120.00000
   52    55    56    35.00000  120.00000
   52    55    60    63.00000  120.00000
   55    52    53    35.00000  120.00000
   55    60    63    70.00000  120.00000
   60    46    47    63.00000  120.00000
   60    55    56    35.00000  120.00000
   60    63    64    35.00000  113.00000
   50    47    48    60.00000  120.93500
   50    54    57    70.00000  124.00000
   54    37    38    35.00000  109.50000
   54    37    44    70.00000  109.06800
   54    50    51    35.00000  120.00000
   54    57    58    35.00000  109.50000
   54    57    59    35.00000  109.50000
   54    57    61    70.00000  112.02700
   57    61    62    37.50000  110.70000
   57    61    39    50.00000  109.50000
   57    61    65    58.35000  112.70000
   59    57    58    33.00000  107.80000
   61    57    58    37.50000  110.70000
   61    57    59    37.50000  110.70000
   61    65    66    37.50000  110.70000
   61    65    67    37.50000  110.70000
   61    65    68    70.00000  109.69300
   39    33    37    50.00000  109.50000
   39    61    62    35.00000  109.50000
   65    61    62    37.50000  110.70000
   65    61    39    50.00000  109.50000
   65    68    69    70.00000  117.00000
   65    68    70    70.00000  117.00000
   67    65    66    33.00000  107.80000
   68    65    66    35.00000  109.50000
   68    65    67    35.00000  109.50000
   70    68    69    80.00000  126.00000
   40    33    37    58.35000  112.70000
   40    33    39    50.00000  109.50000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    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    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  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
   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    44   0.56750  1.0 1.0
   29    33    37    44  -0.07550 -1.0 2.0
   29    33    37    44   0.20000  1.0 3.0
   29    33    37    54   0.56750  1.0 1.0
   29    33    37    54  -0.07550 -1.0 2.0
   29    33    37    54   0.20000  1.0 3.0
   29    33    39    61   0.14700  1.0 1.0
   29    33    39    61  -1.16150 -1.0 2.0
   29    33    39    61   0.48700  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    43   0.15000  1.0 3.0
   33    37    44    45   0.30150 -1.0 2.0
   33    37    44    46   0.05850 -1.0 2.0
   33    37    44    46   0.17250  1.0 3.0
   33    37    54    50   0.09850  1.0 1.0
   33    37    54    50   0.15250 -1.0 2.0
   33    37    54    50  -0.50650  1.0 3.0
   33    37    54    57   0.46850  1.0 1.0
   33    37    54    57   0.08550 -1.0 2.0
   33    37    54    57   0.09800  1.0 3.0
   37    33    39    61   0.06250  1.0 1.0
   37    33    39    61  -0.01100 -1.0 2.0
   37    33    39    61   0.28050  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    43   0.15000  1.0 3.0
   37    44    46    47   2.26350  1.0 1.0
   37    44    46    47   0.76750 -1.0 2.0
   37    44    46    47   0.22500  1.0 3.0
   37    44    46    60   2.26350  1.0 1.0
   37    44    46    60   0.76750 -1.0 2.0
   37    44    46    60   0.22500  1.0 3.0
   37    54    57    58   0.34800  1.0 3.0
   37    54    57    59   0.34800  1.0 3.0
   37    54   -57    61   0.46850  1.0 1.0
   37    54   -57    61   0.08550 -1.0 2.0
   37    54   -57    61   0.09800  1.0 3.0
   38    37    44    45   0.00000  1.0 1.0
   38    37    44    46   0.00000  1.0 1.0
   38    37    54    50   0.00000  1.0 1.0
   38    37    54    57   0.34800  1.0 3.0
   44    37    54    50  -0.51250  1.0 1.0
   44    37    54    50  -0.88800 -1.0 2.0
   44    37    54    50   0.08850  1.0 3.0
   44    37    54    57   0.17250  1.0 1.0
   44    37    54    57  -0.04100 -1.0 2.0
   44    37    54    57  -0.33850  1.0 3.0
   44    46    47    48   3.62500 -1.0 2.0
   44    46   -47    50   3.62500 -1.0 2.0
   44    46    60    55   3.62500 -1.0 2.0
   44    46    60    63   3.62500 -1.0 2.0
   45    44    46    47   1.05000 -1.0 2.0
   45    44    46    60   1.05000 -1.0 2.0
   46    47    48    49   3.62500 -1.0 2.0
   46    47    48    52   3.62500 -1.0 2.0
   46    47    50    51   0.56550  1.0 3.0
   46    47    50    54   0.15800  1.0 1.0
   46    47    50    54   1.85350 -1.0 2.0
   46    47    50    54  -0.48700  1.0 3.0
   46    60    63    64   0.84100 -1.0 2.0
   47    46    60    55   3.62500 -1.0 2.0
   47    46    60    63   3.62500 -1.0 2.0
   47    48    52    53   3.62500 -1.0 2.0
   47    48   -52    55   3.62500 -1.0 2.0
   47    50   -54    37   7.00000 -1.0 2.0
   47    50    54    57   7.00000 -1.0 2.0
   48    47    50    51   0.56550  1.0 3.0
   48    47    50    54   0.15800  1.0 1.0
   48    47    50    54   1.85350 -1.0 2.0
   48    47    50    54  -0.48700  1.0 3.0
   48    52    55    56   3.62500 -1.0 2.0
   48    52    55    60   3.62500 -1.0 2.0
   49    48    52    53   3.62500 -1.0 2.0
   49    48    52    55   3.62500 -1.0 2.0
   52    55   -60    46   3.62500 -1.0 2.0
   52    55    60    63   3.62500 -1.0 2.0
   53    52    55    56   3.62500 -1.0 2.0
   53    52    55    60   3.62500 -1.0 2.0
   55    60    63    64   0.84100 -1.0 2.0
   56    55    60    46   3.62500 -1.0 2.0
   56    55    60    63   3.62500 -1.0 2.0
   60    46   -47    48   3.62500 -1.0 2.0
   60    46    47    50   3.62500 -1.0 2.0
   50    47    48    49   3.62500 -1.0 2.0
   50    47    48    52   3.62500 -1.0 2.0
   50    54    57    58   0.00000  1.0 1.0
   50    54    57    59   0.00000  1.0 1.0
   50    54    57    61   0.09850  1.0 1.0
   50    54    57    61   0.15250 -1.0 2.0
   50    54    57    61  -0.50650  1.0 3.0
   51    50    54    37   7.00000 -1.0 2.0
   51    50    54    57   7.00000 -1.0 2.0
   54    37    44    45   0.30150 -1.0 2.0
   54    37   -44    46   0.65300  1.0 1.0
   54    37   -44    46  -0.03850 -1.0 2.0
   54    37   -44    46   0.33900  1.0 3.0
   54    57    61    62   0.15000  1.0 3.0
   54    57    61    39   0.61850  1.0 1.0
   54    57    61    39  -0.22750 -1.0 2.0
   54    57    61    39   0.15300  1.0 3.0
   54    57    61    65   0.34400  1.0 1.0
   54    57    61    65   0.09450 -1.0 2.0
   54    57    61    65   0.11100  1.0 3.0
   57    61   -39    33   0.06250  1.0 1.0
   57    61   -39    33  -0.01100 -1.0 2.0
   57    61   -39    33   0.28050  1.0 3.0
   57    61    65    66   0.15000  1.0 3.0
   57    61    65    67   0.15000  1.0 3.0
   57    61    65    68  -1.63150  1.0 1.0
   57    61    65    68  -0.43550 -1.0 2.0
   57    61    65    68   0.24500  1.0 3.0
   58    57    61    62   0.15000  1.0 3.0
   58    57    61    39   0.23400  1.0 3.0
   58    57    61    65   0.15000  1.0 3.0
   59    57    61    62   0.15000  1.0 3.0
   59    57    61    39   0.23400  1.0 3.0
   59    57    61    65   0.15000  1.0 3.0
   61    65    68    69   0.41150 -1.0 2.0
   61    65    68    70   0.41150 -1.0 2.0
   62    61    39    33   0.37050  1.0 3.0
   62    61    65    66   0.15000  1.0 3.0
   62    61    65    67   0.15000  1.0 3.0
   62    61    65    68  -0.11250  1.0 3.0
   39    33    37    38   0.23400  1.0 3.0
   39    33    37    44  -0.09450  1.0 1.0
   39    33    37    44  -1.12950 -1.0 2.0
   39    33    37    44   0.54000  1.0 3.0
   39    33   -37    54   0.61850  1.0 1.0
   39    33   -37    54  -0.22750 -1.0 2.0
   39    33   -37    54   0.15300  1.0 3.0
   39    33    40    41   0.23400  1.0 3.0
   39    33    40    42   0.23400  1.0 3.0
   39    33    40    43   0.23400  1.0 3.0
   39    61    65    66   0.23400  1.0 3.0
   39    61    65    67   0.23400  1.0 3.0
   39    61    65    68  -3.35100  1.0 1.0
   39    61    65    68  -0.37050 -1.0 2.0
   39    61    65    68   0.22400  1.0 3.0
   65    61    39    33   0.06250  1.0 1.0
   65    61    39    33  -0.01100 -1.0 2.0
   65    61    39    33   0.28050  1.0 3.0
   66    65    68    69   0.00000  1.0 1.0
   66    65    68    70   0.00000  1.0 1.0
   67    65    68    69   0.00000  1.0 1.0
   67    65    68    70   0.00000  1.0 1.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    44  -0.95700  1.0 1.0
   40    33    37    44  -0.18200 -1.0 2.0
   40    33    37    44   0.29450  1.0 3.0
   40    33    37    54   0.34400  1.0 1.0
   40    33    37    54   0.09450 -1.0 2.0
   40    33    37    54   0.11100  1.0 3.0
   40    33    39    61   0.06250  1.0 1.0
   40    33    39    61  -0.01100 -1.0 2.0
   40    33    39    61   0.28050  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
   37    46    44    45  10.50000 -1.0 2.0
   47    60    46    44   4.00000 -1.0 2.0
   48    50    47    46   4.00000 -1.0 2.0
   52    49    48    47   1.10000 -1.0 2.0
   55    53    52    48   1.10000 -1.0 2.0
   60    56    55    52   1.10000 -1.0 2.0
   55    63    60    46   4.00000 -1.0 2.0
   47    51    50    54   1.10000 -1.0 2.0
   37    57    54    50   1.10000 -1.0 2.0
   69    65    68    70  10.50000 -1.0 2.0
END
