* LIGAND DATABASE FILE (OPLS2005)
*
001      68    70    124    188     356
    1     0 S   NP   _N1_     1    29.39386    94.39966   -17.07117
    2     1 S   H    _HN1     2     1.02787    78.58520   -37.36932
    3     1 S   H    _H1_     3     1.03019   114.13631    67.61018
    4     1 S   H    _H2_     4     1.02828    29.53188   149.46222
    5     1 S   CT   _CA1     5     1.50263   127.36927  -146.72827
    6     5 S   HC   _HA1     6     1.09609   105.15145    30.41675
    7     5 S   CO3  _C1_     7     1.53730   112.61957   -89.08023
    8     7 S   O2Z  _O11     8     1.26286   115.13636   -41.75768
    9     7 S   O2Z  _O12     9     1.26258   114.91703   137.47006
   10     5 S   CT   _CB1    10     1.53049   107.19332   147.57046
   11    10 S   HC   HB11    11     1.09795   108.67476   -57.76926
   12    10 S   HC   HB12    12     1.09591   110.35678    58.02364
   13    10 S   CT   _CG1    13     1.53015   113.40617  -179.82196
   14    13 S   HC   HG11    14     1.09570   109.89180   -66.86757
   15    13 S   HC   HG12    15     1.09613   110.48739    52.10138
   16    13 S   C    _CD1    16     1.51859   111.72980   171.40168
   17    16 S   O    _OE1    17     1.22832   122.53606   -32.95432
   18    16 S   N    _N2_    18     1.38567   112.49493   149.11350
   19    18 S   H    _HN2    19     1.01570   119.25712    -1.28237
   20    18 S   CT1  _CA2    20     1.46261   123.27661   179.49024
   21    20 S   HC   _HA2    21     1.09752   109.12423   -17.96854
   22    20 S   C    _C2_    22     1.53441   108.24797  -133.39425
   23    22 S   O    _O2_    23     1.23009   122.33077  -146.17214
   24    20 S   CT   _CB2    32     1.53497   111.90592   104.15035
   25    24 S   HC   HB21    33     1.09447   110.32441    57.53262
   26    24 S   HC   HB22    34     1.09550   110.21466   175.19005
   27    22 S   N    _N3_    24     1.38551   113.31816    41.29170
   28    27 S   H    _HN3    25     1.01533   118.91000    -0.52526
   29    24 S   S    _SG2    35     1.82741   111.81940   -66.45615
   30    27 S   CT   _CA3    26     1.45434   123.35107   175.15884
   31    30 S   HC   HA31    27     1.09533   109.09846    26.92264
   32    30 S   HC   HA32    28     1.09493   107.15277   143.89794
   33    29 S   CT   _C13    36     1.82924   100.57532   133.39876
   34    33 S   HC   _H9_    37     1.09461   108.28218    54.02387
   35    33 S   HC   _H10    38     1.09358   105.27829   168.93776
   36    30 S   CO3  _C3_    29     1.52934   113.22753   -96.46592
   37    36 S   O2Z  _O31    30     1.26395   115.46033   -43.64121
   38    36 S   O2Z  _O32    31     1.26365   114.94896   137.32062
   39    33 S   CT   _C12    39     1.53391   113.63909   -70.18497
   40    39 S   HC   _H6_    40     1.09515   109.82049    60.00843
   41    39 S   CT   _C11    41     1.53371   114.56266  -177.52812
   42    41 S   HC   _H5_    42     1.09850   107.80122  -151.08838
   43    41 S   CT   _C10    43     1.51891   103.32885    94.25093
   44    43 S   HC   _H4_    44     1.09383   113.20635   159.45395
   45    41 S   OS   _O34    64     1.41217   113.63798   -28.74210
   46    43 S   CO   _C9_    45     1.52381    99.64551    38.38239
   47    46 S   HC   _H3_    46     1.09742   110.04157    77.45313
   48    43 S   OH   _O38    62     1.42451   110.15798   -79.23012
   49    48 S   HO   _H11    63     0.97192   107.67904  -173.43861
   50    45 S   P3   _P1_    65     1.64845   118.69172  -140.20291
   51    50 S   O2Z  _O36    66     1.52451   103.64070  -176.15682
   52    50 S   O2Z  _O37    67     1.52545   104.19938    64.16239
   53    50 S   O2Z  _O35    68     1.52531   104.49237   -56.20012
   54    46 S   N*   _N6_    47     1.44714   116.23341  -160.35380
   55    39 S   OS   _O33    61     1.44518   110.47283   -58.37168
   56    54 S   CRAB _C8_    48     1.37160   124.37789   -92.27362
   57    56 S   HA   _H8_    49     1.08215   122.36036     1.76248
   58    56 S   NNA  _N7_    50     1.31561   112.16517  -177.37579
   59    58 S   C56B _C6_    51     1.37471   104.93660    -0.88382
   60    54 S   C56A _C7_    52     1.36911   128.51927    89.38517
   61    60 S   NB   _N5_    53     1.34153   128.26113    -2.08150
   62    61 S   CQ   _C4_    54     1.34506   111.05545   179.06393
   63    62 S   HA   _H7_    55     1.08482   115.79646  -179.77015
   64    62 S   NB   _N4_    56     1.35294   128.53292     0.19281
   65    59 S   CA   _C5_    57     1.40373   131.54206   179.95154
   66    65 S   NND  _N8_    58     1.38124   122.19358     0.12033
   67    66 S   H    _H12    59     1.01076   120.48202     1.10038
   68    66 S   H    _H13    60     1.01035   119.28698   179.41785
  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   7   5   4   3
  10   5   4   2   1   1  12   6  14   7  11   7   7  11   5   3
   1   3   2   1   1   9   2   6   3   6   8   6   4   4   2   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41    55  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    46    55    45  
   35    39    40    41    55  
   39    40    41    55  
   37    38  
   38  
    0  
   40    41    42    43    44    46    47    54    55    48    45    50  
   41    42    43    46    55    45  
   42    43    44    46    47    54    55    48    49    45    50    51    52    53  
   43    44    46    55    48    45    50  
   44    46    47    54    56    60    55    48    49    45    50  
   46    47    54    55    48    49    45  
   50    51    52    53    46    48    55  
   47    54    56    57    58    59    60    61    55    48    49  
   54    56    60    55    48  
   49    54    55  
    0  
   51    52    53  
   52    53  
   53  
    0  
   56    57    58    59    60    61    62    65    55  
   56    60  
   57    58    59    60    61    65  
   58    59    60  
   59    60    61    64    65    66  
   60    61    62    64    65    66    67    68  
   61    62    63    64    65    66  
   62    63    64    65  
   63    64    65    66  
   64    65  
   65    66    67    68  
   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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.8500   0.1400  -0.760000   1.7660   1.5600   0.020110767  -0.896042159
   46   3.5000   0.0660   0.450000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0500   0.100000   1.4250   1.2500   0.008598240   0.268726247
   48   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   50   3.7400   0.2000   1.919900   2.1070   1.8700   0.005000000   0.000000000
   51   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   52   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   53   2.9800   0.2000  -1.119967   1.6890   1.4900   0.001000000  -0.126889456
   54   3.2500   0.1700  -0.500000   1.8000   1.6000   0.001000000  -0.511443539
   55   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   56   3.5000   0.0800   0.200000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   58   3.2500   0.1700  -0.490000   1.8000   1.6000   0.001000000  -0.511443539
   59   3.5000   0.0800   0.150000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5000   0.0800   0.380000   2.5000   1.7750   0.001000000  -0.843144165
   61   3.2500   0.1700  -0.550000   1.8000   1.6000   0.001000000  -0.511443539
   62   3.5000   0.0800   0.220000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.5000   0.0500   0.200000   1.3810   1.2100   0.030040813   0.268726247
   64   3.2500   0.1700  -0.530000   1.8000   1.6000   0.001000000  -0.511443539
   65   3.5000   0.0800   0.440000   2.0020   1.7750   0.001000000  -0.843144165
   66   3.2500   0.1700  -0.810000   1.8650   1.6500   0.051222218  -2.220205820
   67   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
   68   0.5000   0.0300   0.370000   0.9960   0.8600   0.030040813  -0.651083722
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   268.000  1.529
   39    55   320.000  1.410
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    45   320.000  1.410
   43    44   340.000  1.090
   43    46   250.000  1.527
   43    48   320.000  1.410
   46    47   340.000  1.090
   46    54   275.000  1.479
   46    55   320.000  1.380
   54    56   440.000  1.371
   54    60   436.000  1.374
   56    57   367.000  1.080
   56    58   529.000  1.304
   58    59   414.000  1.391
   59    60   447.000  1.419
   59    65   469.000  1.404
   60    61   461.000  1.354
   61    62   502.000  1.324
   62    63   367.000  1.080
   62    64   502.000  1.324
   64    65   483.000  1.339
   65    66   481.000  1.340
   66    67   434.000  1.010
   66    68   434.000  1.010
   48    49   553.000  0.945
   45    50   230.000  1.630
   50    51   525.000  1.516
   50    52   525.000  1.516
   50    53   525.000  1.516
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    58.35000  112.70000
   33    39    55    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    37.50000  110.70000
   39    41    43    58.35000  112.70000
   39    41    45    50.00000  109.50000
   39    55    46    60.00000  109.50000
   41    39    40    37.50000  110.70000
   41    43    44    37.50000  110.70000
   41    43    46    75.00000  109.43000
   41    43    48    50.00000  109.50000
   41    45    50    80.00000  112.68000
   43    41    42    37.50000  110.70000
   43    46    47    45.00000  112.01100
   43    46    54    75.00000  107.44000
   43    46    55    90.00000  108.56700
   43    48    49    55.00000  108.50000
   46    43    44    45.00000  108.72000
   46    54    56    70.00000  128.80000
   46    54    60    70.00000  125.80000
   54    46    47    55.00000  103.44000
   54    56    57    35.00000  123.05000
   54    56    58    70.00000  113.90000
   54    60    59    70.00000  106.20000
   54    60    61    70.00000  126.20000
   56    58    59    70.00000  103.80000
   58    56    57    35.00000  123.05000
   58    59    60    70.00000  110.40000
   58    59    65    70.00000  132.40000
   59    60    61    70.00000  127.70000
   59    65    64    70.00000  117.30000
   59    65    66    70.00000  123.50000
   60    54    56    70.00000  105.40000
   60    61    62    70.00000  111.00000
   61    62    63    35.00000  115.45000
   61    62    64    70.00000  129.10000
   62    64    65    70.00000  118.60000
   64    62    63    35.00000  115.45000
   64    65    66    70.00000  119.30000
   65    59    60    85.00000  116.20000
   65    66    67    35.00000  120.00000
   65    66    68    35.00000  120.00000
   68    66    67    35.00000  120.00000
   55    39    40    35.00000  109.50000
   55    39    41    50.00000  109.50000
   55    46    47    35.00000  109.50000
   55    46    54   105.00000  106.22000
   48    43    44    35.00000  109.50000
   48    43    46    90.00000  111.58700
   45    41    42    35.00000  109.50000
   45    41    43    50.00000  109.50000
   45    50    51   100.00000  107.00000
   45    50    52   100.00000  107.00000
   45    50    53   100.00000  107.00000
   52    50    51   140.00000  114.00000
   53    50    51   140.00000  114.00000
   53    50    52   140.00000  114.00000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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    35   0.32350  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    39    40   0.15000  1.0 3.0
   29    33    39    41   0.44750  1.0 1.0
   29    33    39    41  -0.17800 -1.0 2.0
   29    33    39    41   0.20200  1.0 3.0
   29    33    39    55   0.56750  1.0 1.0
   29    33    39    55  -0.07550 -1.0 2.0
   29    33    39    55   0.20000  1.0 3.0
   33    39    41    42   0.15000  1.0 3.0
   33    39    41    43   0.56750  1.0 1.0
   33    39    41    43  -0.07550 -1.0 2.0
   33    39    41    43   0.20000  1.0 3.0
   33    39    41    45   0.62750  1.0 1.0
   33    39    41    45  -0.30950 -1.0 2.0
   33    39    41    45   0.27300  1.0 3.0
   33    39    55    46   0.06250  1.0 1.0
   33    39    55    46  -0.01100 -1.0 2.0
   33    39    55    46   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    55   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41   0.15000  1.0 3.0
   35    33    39    55   0.23400  1.0 3.0
   39    41    43    44   0.15000  1.0 3.0
   39    41   -43    46   3.97050  1.0 1.0
   39    41    43    48   0.86500  1.0 1.0
   39    41    43    48  -0.17500 -1.0 2.0
   39    41    43    48   0.20800  1.0 3.0
   39    41    45    50  -2.65550  1.0 1.0
   39    41    45    50  -0.22350 -1.0 2.0
   39    41    45    50   0.24150  1.0 3.0
   40    39    41    42   0.15000  1.0 3.0
   40    39    41    43   0.15000  1.0 3.0
   40    39    41    45   0.23400  1.0 3.0
   40    39    55    46   0.37050  1.0 3.0
   41    39   -55    46   0.06250  1.0 1.0
   41    39   -55    46  -0.01100 -1.0 2.0
   41    39   -55    46   0.28050  1.0 3.0
   41    43    46    47   0.15000  1.0 3.0
   41    43    46    54  -0.64600  1.0 1.0
   41    43    46    54   0.58400 -1.0 2.0
   41    43   -46    55   0.62750  1.0 1.0
   41    43   -46    55  -0.30950 -1.0 2.0
   41    43   -46    55   0.27300  1.0 3.0
   41    43    48    49  -0.11600  1.0 1.0
   41    43    48    49  -0.09450 -1.0 2.0
   41    43    48    49   0.21250  1.0 3.0
   41    45    50    51   0.00000  1.0 1.0
   41    45    50    52   0.00000  1.0 1.0
   41    45    50    53   0.00000  1.0 1.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    46   0.15000  1.0 3.0
   42    41    43    48   0.23400  1.0 3.0
   42    41    45    50   0.03000  1.0 3.0
   43    41    45    50  -2.65550  1.0 1.0
   43    41    45    50  -0.22350 -1.0 2.0
   43    41    45    50   0.24150  1.0 3.0
   43    46    54    56   1.10250  1.0 1.0
   43    46    54    56   0.01650 -1.0 2.0
   43    46    54    56   0.39100  1.0 3.0
   43    46    54    60   1.10250  1.0 1.0
   43    46    54    60   0.01650 -1.0 2.0
   43    46    54    60   0.39100  1.0 3.0
   43    46   -55    39   0.06250  1.0 1.0
   43    46   -55    39  -0.01100 -1.0 2.0
   43    46   -55    39   0.28050  1.0 3.0
   44    43    46    47   0.15000  1.0 3.0
   44    43    46    54   0.15000  1.0 3.0
   44    43    46    55   0.23400  1.0 3.0
   44    43    48    49   0.19450  1.0 3.0
   46    43    48    49  -0.11600  1.0 1.0
   46    43    48    49  -0.09450 -1.0 2.0
   46    43    48    49   0.21250  1.0 3.0
   46    54    56    57   3.62500 -1.0 2.0
   46    54    56    58   3.62500 -1.0 2.0
   46    54    60    59   0.81400  1.0 1.0
   46    54    60    59   1.55550 -1.0 2.0
   46    54    60    61   3.62500 -1.0 2.0
   47    46    54    56   0.00000  1.0 1.0
   47    46    54    60   0.00000  1.0 1.0
   47    46    55    39   0.37050  1.0 3.0
   54    46    55    39  -2.37750  1.0 1.0
   54    46    55    39  -0.08150 -1.0 2.0
   54    46    55    39   0.59000  1.0 3.0
   54    56   -58    59   3.62500 -1.0 2.0
   54    60    61    62   3.62500 -1.0 2.0
   56    54   -60    59   0.70250  1.0 1.0
   56    54   -60    59   1.56150 -1.0 2.0
   56    54    60    61   3.62500 -1.0 2.0
   56    58   -59    60   3.62500 -1.0 2.0
   56    58    59    65   3.62500 -1.0 2.0
   57    56    58    59   3.62500 -1.0 2.0
   58    59   -60    54   3.62500 -1.0 2.0
   58    59    60    61   3.62500 -1.0 2.0
   58    59    65    64   3.62500 -1.0 2.0
   58    59    65    66   3.62500 -1.0 2.0
   59    60    61    62   3.62500 -1.0 2.0
   59    65    66    67   0.70000 -1.0 2.0
   59    65    66    68   0.70000 -1.0 2.0
   60    54    56    57   3.62500 -1.0 2.0
   60    54   -56    58   3.62500 -1.0 2.0
   60    59    65    64   3.62500 -1.0 2.0
   60    59    65    66   3.62500 -1.0 2.0
   60    61    62    63   3.62500 -1.0 2.0
   60    61   -62    64   3.62500 -1.0 2.0
   61    62    64    65   3.62500 -1.0 2.0
   62    64   -65    59   3.62500 -1.0 2.0
   62    64    65    66   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   64    65    66    67   0.70000 -1.0 2.0
   64    65    66    68   0.70000 -1.0 2.0
   65    59    60    54   3.00000 -1.0 2.0
   65    59   -60    61   3.62500 -1.0 2.0
   55    39    41    42   0.23400  1.0 3.0
   55    39   -41    43   0.62750  1.0 1.0
   55    39   -41    43  -0.30950 -1.0 2.0
   55    39   -41    43   0.27300  1.0 3.0
   55    39    41    45   1.11900  1.0 1.0
   55    39    41    45  -1.16350 -1.0 2.0
   55    39    41    45  -0.34150  1.0 3.0
   55    46    54    56   0.10350  1.0 1.0
   55    46    54    56  -0.15350 -1.0 2.0
   55    46    54    60   0.10350  1.0 1.0
   55    46    54    60  -0.15350 -1.0 2.0
   48    43    46    47   0.23400  1.0 3.0
   48    43    46    54   2.76900  1.0 1.0
   48    43    46    54  -0.24350 -1.0 2.0
   48    43    46    54  -0.78250  1.0 3.0
   48    43    46    55   3.69350  1.0 1.0
   48    43    46    55  -1.82950 -1.0 2.0
   45    41    43    44   0.23400  1.0 3.0
   45    41    43    46   0.62750  1.0 1.0
   45    41    43    46  -0.30950 -1.0 2.0
   45    41    43    46   0.27300  1.0 3.0
   45    41    43    48   3.69350  1.0 1.0
   45    41    43    48  -1.82950 -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
   37    30    36    38  10.50000 -1.0 2.0
   56    60    54    46   4.00000 -1.0 2.0
   58    57    56    54   1.10000 -1.0 2.0
   60    65    59    58   4.00000 -1.0 2.0
   59    61    60    54   4.00000 -1.0 2.0
   64    63    62    61   1.10000 -1.0 2.0
   64    66    65    59   4.00000 -1.0 2.0
   68    65    66    67   1.00000 -1.0 2.0
END
