* LIGAND DATABASE FILE (OPLS2005)
*
001      72    75    142    225     411
    1     0 S   NP   _N1_     1    29.10318    94.67374   -19.11903
    2     1 S   H    _HN1     2     1.02964    97.89064    26.74123
    3     1 S   H    _H1_     3     1.02848    38.63458   134.31088
    4     1 S   H    _H2_     4     1.02786    75.73412   -80.18495
    5     1 S   CT   _CA1     5     1.50045   145.04524   171.37256
    6     5 S   HC   _HA1     6     1.09572   105.35804    35.63072
    7     5 S   CO3  _C1_     7     1.53774   112.23697   -84.77900
    8     7 S   O2Z  _O11     8     1.26333   115.06070   -50.25322
    9     7 S   O2Z  _O12     9     1.26234   114.91378   129.22880
   10     5 S   CT   _CB1    10     1.53087   107.48236   153.56122
   11    10 S   HC   HB11    11     1.09817   109.50398   -51.68582
   12    10 S   HC   HB12    12     1.09831   110.36820    64.86696
   13    10 S   CT   _CG1    13     1.53006   112.55954  -172.83796
   14    13 S   HC   HG11    14     1.09597   110.34120   -58.38525
   15    13 S   HC   HG12    15     1.09616   110.20261    60.80546
   16    13 S   C    _CD1    16     1.51748   112.06995  -178.83786
   17    16 S   O    _OE1    17     1.22718   123.17044   -12.52423
   18    16 S   N    _N2_    18     1.38560   111.65081   167.86059
   19    18 S   H    _HN2    19     1.01575   119.09317     2.35401
   20    18 S   CT1  _CA2    20     1.46240   123.41152  -176.23251
   21    20 S   HC   _HA2    21     1.09723   109.46656   -12.66174
   22    20 S   C    _C2_    22     1.53361   108.29118  -128.52792
   23    22 S   O    _O2_    23     1.23005   122.31703  -144.91979
   24    20 S   CT   _CB2    32     1.53398   111.00859   109.34795
   25    24 S   HC   HB21    33     1.09555   109.56427    55.48860
   26    24 S   HC   HB22    34     1.09506   110.75444   174.13425
   27    22 S   N    _N3_    24     1.38538   113.31235    42.40840
   28    27 S   H    _HN3    25     1.01526   118.90154    -0.47105
   29    24 S   S    _SG2    35     1.82923   111.60835   -66.32843
   30    27 S   CT   _CA3    26     1.45445   123.40695   175.14934
   31    30 S   HC   HA31    27     1.09526   109.18617    25.36191
   32    30 S   HC   HA32    28     1.09494   107.13354   142.35592
   33    29 S   CT   _C12    36     1.86044    99.49450   156.96418
   34    33 S   HC   _H8_    37     1.09840   105.09304    41.34216
   35    30 S   CO3  _C3_    29     1.52928   113.15381   -98.08146
   36    35 S   O2Z  _O31    30     1.26399   115.41966   -44.18832
   37    35 S   O2Z  _O32    31     1.26358   114.97339   136.75474
   38    33 S   CM   _C13    38     1.50494   110.16348   -76.53298
   39    33 S   CT   _C11    58     1.58976   115.76704   159.99251
   40    39 S   OM   _O36    59     1.32389   110.55588   -42.61137
   41    39 S   HC   _H7_    60     1.09630   103.67852  -168.51328
   42    38 S   CM   _C14    39     1.33388   130.77823   -31.12277
   43    42 S   HC   _H15    40     1.08100   124.97064     7.25066
   44    42 S   CT   _C15    41     1.47454   111.70809  -163.07726
   45    44 S   HC   _H9_    42     1.09561   109.73156  -119.83281
   46    44 S   CT   _C6_    43     1.55522   115.92203   112.87964
   47    46 S   HC   _H4_    44     1.09905   109.51622  -128.27362
   48    44 S   OS   _O34    70     1.43684   103.12228    -6.87906
   49    46 S   CT   _C5_    45     1.53566   109.58666   112.95768
   50    49 S   HC   _H3_    46     1.09561   111.01323   -41.40147
   51    38 S   CO4  _C16    71     1.46936   122.68885   158.89185
   52    51 S   O    _O35    72     1.21862   125.81009   -13.09869
   53    49 S   CO4  _C18    47     1.50018   103.20617  -156.05169
   54    53 S   O    _O38    48     1.22114   126.19579  -160.54475
   55    49 S   CT   _C4_    66     1.52114   112.88112    82.98578
   56    55 S   HC   _H10    67     1.09568   111.42522    60.42332
   57    55 S   HC   _H11    68     1.09427   111.26718   -60.48280
   58    55 S   HC   _H12    69     1.09543   110.60450   179.59266
   59    53 S   OS   _O37    49     1.36028   109.48253    20.86464
   60    46 S   CT   _C7_    50     1.54325   118.65814    -3.12387
   61    60 S   HC   _H5_    51     1.09405   112.79889    34.71137
   62    60 S   CT   _C8_    52     1.53691   117.83071   -95.20687
   63    62 S   HC   _H13    53     1.09950   107.73532  -173.00978
   64    62 S   HC   _H14    54     1.09881   108.89394   -61.03036
   65    62 S   C3T  _C9_    55     1.50770   116.65352    63.78375
   66    65 S   C3T  _C10    56     1.54808   119.06382    65.65928
   67    66 S   HC   _H6_    57     1.08510   118.22783    -4.30748
   68    65 S   CT   _C17    62     1.50606   114.60391  -103.88255
   69    68 S   HC   _H16    63     1.09168   113.64371  -179.48452
   70    68 S   HC   _H17    64     1.09215   111.08458    58.11302
   71    68 S   HC   _H18    65     1.09626   109.69140   -60.19415
   72    65 S   O3T  _O33    61     1.44480   113.51969   129.50915
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   9   5   4   3
  15   7   2   1   1  12  10   5   4  10   5  14   6  18   9   4
  11   8   1   1   9   3   5   2   1   1   6   8   4  10   5   4
   7   6   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    66    39    40    41    51  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    44    65    66    67    39    40    41    72    48    51    52  
   38    42    66    39    40    41    51  
   36    37  
   37  
    0  
   42    43    44    45    46    66    39    40    41    48    51    52  
   40    41    72    68    51    42    62    65    66    67  
   41    72    65    66    67  
   72    65    66    67  
   43    44    45    46    47    49    60    48    51    52  
   44    45    46    48    51  
   45    46    47    49    50    53    59    60    61    62    55    48    51    52  
   46    47    49    60    48    51  
   47    49    50    53    54    59    60    61    62    63    64    65    55    56    57    58    48    51  
   49    50    53    59    60    61    62    55    48  
   51    52    49    60  
   50    53    54    59    60    61    62    55    56    57    58  
   53    54    59    60    55    56    57    58  
   52  
    0  
   54    59    60    61    62    55    56    57    58  
   59    60    55  
   56    57    58    59    60  
   57    58  
   58  
    0  
   60    61    62    63    64    65  
   61    62    63    64    65    66    72    68  
   62    63    64    65  
   63    64    65    66    67    72    68    69    70    71  
   64    65    66    72    68  
   65    66    72    68  
   66    67    72    68    69    70    71  
   67    72    68    69    70    71  
   72    68  
   69    70    71    72  
   70    71    72  
   71    72  
   72  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   41   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.289000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   62   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   66   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    42   549.000  1.340
   38    51   320.000  1.462
   42    43   340.000  1.080
   42    44   317.000  1.510
   44    45   340.000  1.090
   44    46   268.000  1.529
   44    48   320.000  1.410
   46    47   340.000  1.090
   46    49   268.000  1.529
   46    60   268.000  1.529
   49    50   340.000  1.090
   49    53   317.000  1.522
   49    55   268.000  1.529
   53    54   570.000  1.229
   53    59   214.000  1.327
   59    60   320.000  1.410
   60    61   340.000  1.090
   60    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   275.000  1.510
   65    66   260.000  1.509
   65    72   335.000  1.432
   65    68   275.000  1.510
   66    67   340.000  1.088
   66    39   275.000  1.510
   66    72   335.000  1.432
   39    40   570.000  1.307
   39    41   340.000  1.090
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   48    51   214.000  1.327
   51    52   570.000  1.229
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    39    75.00000  111.63000
   33    38    42    70.00000  124.00000
   33    38    51    65.00000  116.34900
   33    39    66    70.00000  112.37300
   33    39    40    50.00000  109.50000
   33    39    41    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    44    70.00000  124.00000
   38    51    48    90.00000  111.29400
   38    51    52    80.00000  123.72100
   42    44    45    35.00000  109.50000
   42    44    46    70.00000  112.02700
   42    44    48    85.00000  110.90400
   44    42    43    35.00000  117.00000
   44    46    47    37.50000  110.70000
   44    46    49    58.35000  112.70000
   44    46    60    58.35000  112.70000
   44    48    51    83.00000  116.90000
   46    44    45    37.50000  110.70000
   46    49    50    37.50000  110.70000
   46    49    53    63.00000  111.10000
   46    49    55    58.35000  112.70000
   46    60    59    50.00000  109.50000
   46    60    61    37.50000  110.70000
   46    60    62    58.35000  112.70000
   49    46    47    37.50000  110.70000
   49    53    54    80.00000  120.40000
   49    53    59    81.00000  111.40000
   49    55    56    37.50000  110.70000
   49    55    57    37.50000  110.70000
   49    55    58    37.50000  110.70000
   53    49    50    35.00000  109.50000
   53    59    60    83.00000  116.90000
   59    53    54    83.00000  123.40000
   59    60    61    35.00000  109.50000
   59    60    62    50.00000  109.50000
   60    46    47    37.50000  110.70000
   60    46    49    58.35000  112.70000
   60    62    63    37.50000  110.70000
   60    62    64    37.50000  110.70000
   60    62    65    70.00000  112.37300
   62    60    61    37.50000  110.70000
   62    65    66    60.00000  120.94000
   62    65    72    80.00000  116.47100
   62    65    68    58.35000  112.70000
   64    62    63    33.00000  107.80000
   65    62    63    45.00000  109.38400
   65    62    64    45.00000  109.38400
   65    66    67    37.50000  117.20000
   65    66    39    60.00000  120.94000
   65    66    72    15.00000   60.43100
   65    72    66    15.00000   59.14900
   65    68    69    45.00000  109.38400
   65    68    70    45.00000  109.38400
   65    68    71    45.00000  109.38400
   66    39    40    50.00000  109.50000
   66    39    41    45.00000  109.38400
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.02700
   39    66    67    40.00000  115.04500
   41    39    40    45.00000  125.66300
   72    65    66    15.00000   60.43100
   72    66    67    50.00000  114.27700
   72    66    39    80.00000  116.47100
   68    65    66    60.00000  120.94000
   68    65    72    80.00000  116.47100
   70    68    69    33.00000  107.80000
   71    68    69    33.00000  107.80000
   71    68    70    33.00000  107.80000
   55    49    50    37.50000  110.70000
   55    49    53    63.00000  111.10000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   48    44    45    35.00000  109.50000
   48    44    46    50.00000  109.50000
   48    51    52    83.00000  123.40000
   51    38    42    65.00000  118.96000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    42   0.42700  1.0 1.0
   29    33    38    42  -0.70350 -1.0 2.0
   29    33    38    42  -0.43150  1.0 3.0
   29    33    38    51   0.09700  1.0 1.0
   29    33    38    51   0.15600 -1.0 2.0
   29    33    38    51  -0.50800  1.0 3.0
   29    33    39    66   0.44750  1.0 1.0
   29    33    39    66  -0.17800 -1.0 2.0
   29    33    39    66   0.20200  1.0 3.0
   29    33    39    40   0.56750  1.0 1.0
   29    33    39    40  -0.07550 -1.0 2.0
   29    33    39    40   0.20000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   33    38    42    43   7.00000 -1.0 2.0
   33    38    42    44   7.00000 -1.0 2.0
   33    38    51    48  -0.15000  1.0 1.0
   33    38    51    48   0.89550 -1.0 2.0
   33    38    51    48  -0.06900  1.0 3.0
   33    38    51    52  -0.64400  1.0 1.0
   33    38    51    52   0.26850 -1.0 2.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    51   0.15000  1.0 3.0
   34    33    39    66   0.15000  1.0 3.0
   34    33    39    40   0.23400  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   38    33    39    66   0.34400  1.0 1.0
   38    33    39    66   0.09450 -1.0 2.0
   38    33    39    66   0.11100  1.0 3.0
   38    33    39    40   0.61850  1.0 1.0
   38    33    39    40  -0.22750 -1.0 2.0
   38    33    39    40   0.15300  1.0 3.0
   38    33    39    41   0.15000  1.0 3.0
   38    42    44    45   0.00000  1.0 1.0
   38    42    44    46   0.09850  1.0 1.0
   38    42    44    46   0.15250 -1.0 2.0
   38    42    44    46  -0.50650  1.0 3.0
   38    42   -44    48   0.39000  1.0 1.0
   38    42   -44    48  -0.05800 -1.0 2.0
   38    42   -44    48  -0.55150  1.0 3.0
   42    38   -51    48  -0.56150  1.0 1.0
   42    38   -51    48   2.19150 -1.0 2.0
   42    38    51    52   1.00000 -1.0 2.0
   42    44    46    47   0.15000  1.0 3.0
   42    44    46    49   0.34400  1.0 1.0
   42    44    46    49   0.09450 -1.0 2.0
   42    44    46    49   0.11100  1.0 3.0
   42    44    46    60   0.34400  1.0 1.0
   42    44    46    60   0.09450 -1.0 2.0
   42    44    46    60   0.11100  1.0 3.0
   42    44   -48    51  -0.82050  1.0 1.0
   42    44   -48    51   0.00600 -1.0 2.0
   42    44   -48    51   0.04400  1.0 3.0
   43    42    44    45   0.33100  1.0 3.0
   43    42    44    46   0.00000  1.0 1.0
   43    42    44    48   0.00000  1.0 1.0
   44    46    49    50   0.15000  1.0 3.0
   44    46    49    53  -0.95700  1.0 1.0
   44    46    49    53  -0.18200 -1.0 2.0
   44    46    49    53   0.29450  1.0 3.0
   44    46    49    55   0.56750  1.0 1.0
   44    46    49    55  -0.07550 -1.0 2.0
   44    46    49    55   0.20000  1.0 3.0
   44    46    60    59   0.62750  1.0 1.0
   44    46    60    59  -0.30950 -1.0 2.0
   44    46    60    59   0.27300  1.0 3.0
   44    46    60    61   0.15000  1.0 3.0
   44    46    60    62   0.56750  1.0 1.0
   44    46    60    62  -0.07550 -1.0 2.0
   44    46    60    62   0.20000  1.0 3.0
   44    48   -51    38   2.00000 -1.0 2.0
   44    48    51    52   3.00000 -1.0 2.0
   45    44    46    47   0.15000  1.0 3.0
   45    44    46    49   0.15000  1.0 3.0
   45    44    46    60   0.15000  1.0 3.0
   45    44    48    51   0.08050  1.0 3.0
   46    44    48    51  -0.25900  1.0 1.0
   46    44    48    51  -0.47000 -1.0 2.0
   46    44    48    51   0.11750  1.0 3.0
   46    49    53    54   0.30150 -1.0 2.0
   46    49   -53    59   0.36750  1.0 3.0
   46    49    55    56   0.15000  1.0 3.0
   46    49    55    57   0.15000  1.0 3.0
   46    49    55    58   0.15000  1.0 3.0
   46    60    62    63   0.15000  1.0 3.0
   46    60    62    64   0.15000  1.0 3.0
   46    60    62    65   0.47050  1.0 1.0
   46    60    62    65   0.03900 -1.0 2.0
   46    60    62    65   0.20100  1.0 3.0
   47    46    49    50   0.15000  1.0 3.0
   47    46    49    53  -0.11250  1.0 3.0
   47    46    49    55   0.15000  1.0 3.0
   47    46    60    59   0.23400  1.0 3.0
   47    46    60    61   0.15000  1.0 3.0
   47    46    60    62   0.15000  1.0 3.0
   49    46   -60    59   0.62750  1.0 1.0
   49    46   -60    59  -0.30950 -1.0 2.0
   49    46   -60    59   0.27300  1.0 3.0
   49    46    60    61   0.15000  1.0 3.0
   49    46    60    62   0.56750  1.0 1.0
   49    46    60    62  -0.07550 -1.0 2.0
   49    46    60    62   0.20000  1.0 3.0
   49    53   -59    60   1.63150  1.0 1.0
   49    53   -59    60   2.92000 -1.0 2.0
   50    49    53    54   0.00000  1.0 1.0
   50    49    53    59   0.00000  1.0 1.0
   50    49    55    56   0.15000  1.0 3.0
   50    49    55    57   0.15000  1.0 3.0
   50    49    55    58   0.15000  1.0 3.0
   53    49    55    56  -0.11250  1.0 3.0
   53    49    55    57  -0.11250  1.0 3.0
   53    49    55    58  -0.11250  1.0 3.0
   53    59   -60    46  -0.25900  1.0 1.0
   53    59   -60    46  -0.47000 -1.0 2.0
   53    59   -60    46   0.11750  1.0 3.0
   53    59    60    61   0.08050  1.0 3.0
   53    59    60    62  -0.25900  1.0 1.0
   53    59    60    62  -0.47000 -1.0 2.0
   53    59    60    62   0.11750  1.0 3.0
   54    53    59    60   3.00000 -1.0 2.0
   59    60    62    63   0.23400  1.0 3.0
   59    60    62    64   0.23400  1.0 3.0
   59    60    62    65  -0.26800  1.0 1.0
   59    60    62    65   0.69150 -1.0 2.0
   59    60    62    65  -0.48750  1.0 3.0
   60    46    49    50   0.15000  1.0 3.0
   60    46   -49    53  -0.95700  1.0 1.0
   60    46   -49    53  -0.18200 -1.0 2.0
   60    46   -49    53   0.29450  1.0 3.0
   60    46    49    55   0.56750  1.0 1.0
   60    46    49    55  -0.07550 -1.0 2.0
   60    46    49    55   0.20000  1.0 3.0
   60    62    65    66   0.07850  1.0 1.0
   60    62    65    66  -0.03950 -1.0 2.0
   60    62    65    66   0.67350  1.0 3.0
   60    62    65    72   0.02550  1.0 1.0
   60    62    65    72  -0.02600 -1.0 2.0
   60    62    65    72   1.20400  1.0 3.0
   60    62    65    68   0.56750  1.0 1.0
   60    62    65    68  -0.07550 -1.0 2.0
   60    62    65    68   0.20000  1.0 3.0
   61    60    62    63   0.15000  1.0 3.0
   61    60    62    64   0.15000  1.0 3.0
   61    60    62    65   0.15000  1.0 3.0
   62    65    66    67   0.15000  1.0 3.0
   62    65    66    39   0.56750  1.0 1.0
   62    65    66    39  -0.07550 -1.0 2.0
   62    65    66    39   0.20000  1.0 3.0
   62    65   -66    72   0.02550  1.0 1.0
   62    65   -66    72  -0.02600 -1.0 2.0
   62    65   -66    72   1.20400  1.0 3.0
   62    65   -72    66   0.06250  1.0 1.0
   62    65   -72    66  -0.01100 -1.0 2.0
   62    65   -72    66   0.28050  1.0 3.0
   62    65    68    69   0.15000  1.0 3.0
   62    65    68    70   0.15000  1.0 3.0
   62    65    68    71   0.15000  1.0 3.0
   63    62    65    66   0.15000  1.0 3.0
   63    62    65    72   0.23400  1.0 3.0
   63    62    65    68   0.15000  1.0 3.0
   64    62    65    66   0.15000  1.0 3.0
   64    62    65    72   0.23400  1.0 3.0
   64    62    65    68   0.15000  1.0 3.0
   65    66    39    33   0.07850  1.0 1.0
   65    66    39    33  -0.03950 -1.0 2.0
   65    66    39    33   0.67350  1.0 3.0
   65    66    39    40  -0.26800  1.0 1.0
   65    66    39    40   0.69150 -1.0 2.0
   65    66    39    40  -0.48750  1.0 3.0
   65    66    39    41   0.15000  1.0 3.0
   66    65    68    69   0.15000  1.0 3.0
   66    65    68    70   0.15000  1.0 3.0
   66    65    68    71   0.15000  1.0 3.0
   67    66    39    33   0.15000  1.0 3.0
   67    66    39    40   0.23400  1.0 3.0
   67    66    39    41   0.15000  1.0 3.0
   67    66   -72    65   0.36800  1.0 3.0
   39    33    38    42   0.09850  1.0 1.0
   39    33    38    42   0.15250 -1.0 2.0
   39    33    38    42  -0.50650  1.0 3.0
   39    33    38    51   0.09700  1.0 1.0
   39    33    38    51   0.15600 -1.0 2.0
   39    33    38    51  -0.50800  1.0 3.0
   39    66   -72    65   0.06250  1.0 1.0
   39    66   -72    65  -0.01100 -1.0 2.0
   39    66   -72    65   0.28050  1.0 3.0
   72    65   -66    67   0.23400  1.0 3.0
   72    65   -66    39   0.02550  1.0 1.0
   72    65   -66    39  -0.02600 -1.0 2.0
   72    65   -66    39   1.20400  1.0 3.0
   72    65    68    69   0.23400  1.0 3.0
   72    65    68    70   0.23400  1.0 3.0
   72    65    68    71   0.23400  1.0 3.0
   72    66    39    33   0.02550  1.0 1.0
   72    66    39    33  -0.02600 -1.0 2.0
   72    66    39    33   1.20400  1.0 3.0
   72    66    39    40   1.11900  1.0 1.0
   72    66    39    40  -1.16350 -1.0 2.0
   72    66    39    40  -0.34150  1.0 3.0
   72    66    39    41   0.23400  1.0 3.0
   68    65    66    67   0.15000  1.0 3.0
   68    65    66    39   0.56750  1.0 1.0
   68    65    66    39  -0.07550 -1.0 2.0
   68    65    66    39   0.20000  1.0 3.0
   68    65   -66    72   0.02550  1.0 1.0
   68    65   -66    72  -0.02600 -1.0 2.0
   68    65   -66    72   1.20400  1.0 3.0
   68    65   -72    66   0.06250  1.0 1.0
   68    65   -72    66  -0.01100 -1.0 2.0
   68    65   -72    66   0.28050  1.0 3.0
   55    49    53    54   0.30150 -1.0 2.0
   55    49    53    59   0.36750  1.0 3.0
   48    44    46    47   0.23400  1.0 3.0
   48    44    46    49   0.62750  1.0 1.0
   48    44    46    49  -0.30950 -1.0 2.0
   48    44    46    49   0.27300  1.0 3.0
   48    44    46    60   0.62750  1.0 1.0
   48    44    46    60  -0.30950 -1.0 2.0
   48    44    46    60   0.27300  1.0 3.0
   51    38    42    43   7.00000 -1.0 2.0
   51    38   -42    44   7.00000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    51    38    42   1.10000 -1.0 2.0
   44    43    42    38   1.10000 -1.0 2.0
   49    59    53    54  10.50000 -1.0 2.0
   38    48    51    52  10.50000 -1.0 2.0
END
