* LIGAND DATABASE FILE (OPLS2005)
*
001      61    62    114    176     335
    1     0 S   NP   _N1_     1    29.02144    93.33622   -22.18100
    2     1 S   H    _HN1     2     1.02787    89.16845  -114.11154
    3     1 S   H    _H1_     3     1.02949    96.57173    -5.79322
    4     1 S   H    _H2_     4     1.02847    26.36973   110.00089
    5     1 S   CT   _CA1     5     1.50145   136.57923   123.58399
    6     5 S   HC   _HA1     6     1.09566   105.25826    53.24368
    7     5 S   CO3  _C1_     7     1.53925   111.95623   -67.06245
    8     7 S   O2Z  _O11     8     1.26398   115.04031   -50.59345
    9     7 S   O2Z  _O12     9     1.26220   114.85358   128.05082
   10     5 S   CT   _CB1    10     1.53051   107.40378   171.20011
   11    10 S   HC   HB11    11     1.09828   109.74694   -47.87888
   12    10 S   HC   HB12    12     1.09809   110.23385    68.67745
   13    10 S   CT   _CG1    13     1.53067   112.61320  -168.78725
   14    13 S   HC   HG11    14     1.09535   110.54467   -56.29885
   15    13 S   HC   HG12    15     1.09616   110.07860    62.91904
   16    13 S   C    _CD1    16     1.51794   111.90521  -176.61823
   17    16 S   O    _OE1    17     1.22769   123.14316    -5.73719
   18    16 S   N    _N2_    18     1.38587   112.02401   174.07130
   19    18 S   H    _HN2    19     1.01572   119.11063     4.32735
   20    18 S   CT1  _CA2    20     1.46133   123.21240  -175.94938
   21    20 S   HC   _HA2    21     1.09618   109.13909     8.30813
   22    20 S   C    _C2_    22     1.53518   109.27415  -107.24421
   23    22 S   O    _O2_    23     1.23071   122.06120  -143.28297
   24    20 S   CT   _CB2    32     1.53498   111.74208   129.96981
   25    24 S   HC   HB21    33     1.09662   109.57946    67.88570
   26    24 S   HC   HB22    34     1.09585   110.62258  -175.01190
   27    22 S   N    _N3_    24     1.38447   113.77009    44.04414
   28    27 S   H    _HN3    25     1.01457   119.15423     0.42978
   29    24 S   S    _SG2    35     1.82752   115.15786   -51.68025
   30    27 S   CT   _CA3    26     1.45450   123.26651   175.33944
   31    30 S   HC   HA31    27     1.09533   109.11457    27.55134
   32    30 S   HC   HA32    28     1.09494   107.16377   144.52456
   33    29 S   CT   _C13    36     1.82052   100.31336   -63.74370
   34    33 S   HC   _H3_    37     1.09484   108.47155   -58.72111
   35    33 S   HC   _H4_    38     1.09369   110.68811    58.61199
   36    30 S   CO3  _C3_    29     1.52928   113.13717   -95.84332
   37    36 S   O2Z  _O31    30     1.26400   115.40120   -45.28149
   38    36 S   O2Z  _O32    31     1.26355   114.99059   135.64342
   39    33 S   CM   _C4_    39     1.50043   109.89557   179.49024
   40    39 S   CMA  _C5_    40     1.35345   127.20876    96.63283
   41    40 S   OM   _O33    41     1.26302   128.07223    -2.67956
   42    40 S   OS   _O13    42     1.42862   109.62739   176.23381
   43    42 S   CT   _C10    43     1.44044   105.54881    16.62457
   44    43 S   HC   _H21    44     1.09621   107.97295  -147.58265
   45    43 S   CT   _C8_    45     1.53673   108.16841    93.95199
   46    45 S   HC   _H18    46     1.09971   110.09593   -43.59454
   47    45 S   HC   _H19    47     1.09847   109.34357    69.52799
   48    45 S   CT   _C11    48     1.52483   113.71511  -166.42585
   49    48 S   CO4  _C6_    49     1.52488   107.94195    53.75555
   50    49 S   O    _O34    50     1.23095   122.19864   128.66024
   51    48 S   CT   _C12    56     1.52624   113.05945   -69.35114
   52    51 S   HC   _H22    57     1.09582   110.71289   -62.22216
   53    51 S   HC   _H23    58     1.09637   110.60602   179.88131
   54    51 S   HC   _H24    59     1.09390   112.75709    59.37347
   55    48 S   OH   _O14    60     1.42392   107.74877   171.34111
   56    55 S   HO   _H27    61     0.97339   107.61538  -174.20417
   57    49 S   CT   _C7_    51     1.51240   116.48093   -54.87734
   58    57 S   HC   _H16    52     1.09234   109.03807   173.05836
   59    57 S   HC   _H17    53     1.09650   106.79412   -72.43918
   60    39 S   CT   _C9_    54     1.50046   122.03637   -91.67542
   61    60 S   HC   _H20    55     1.09980   105.74842   -80.38092
  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   6   5   4   3
  10   4   3   2   1   1  12   8   3   9  13   7  14   6   5  12
  12   6   6   3   2   1   2   1   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    60  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    57    60    61  
   35    39    40    60  
   39    40    60  
   37    38  
   38  
    0  
   40    41    42    43    44    45    49    57    58    59    60    61  
   41    42    43    44    45    57    60    61  
   42    43    60  
   43    44    45    46    47    48    57    60    61  
   44    45    46    47    48    49    57    58    59    60    61    51    55  
   45    46    47    48    57    60    61  
   46    47    48    49    50    57    60    61    51    52    53    54    55    56  
   47    48    49    60    51    55  
   48    49    60    51    55  
   49    50    57    58    59    60    51    52    53    54    55    56  
   50    57    58    59    60    61    51    52    53    54    55    56  
   57    58    59    60    51    55  
   52    53    54    55    56    57  
   53    54    55  
   54    55  
   55  
   56    57  
    0  
   58    59    60    61  
   59    60    61  
   60    61  
   61  
    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   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   49   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   51   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   56   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   59   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   317.000  1.510
   39    40   465.000  1.376
   39    60   317.000  1.510
   40    41   745.000  1.250
   40    42   440.000  1.360
   42    43   320.000  1.410
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    60   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   268.000  1.529
   48    49   317.000  1.522
   48    51   268.000  1.529
   48    55   320.000  1.410
   49    50   570.000  1.229
   49    57   317.000  1.522
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   268.000  1.529
   60    61   340.000  1.090
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   340.000  1.090
   55    56   553.000  0.945
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  112.20000
   33    39    40    70.00000  124.00000
   33    39    60    65.00000  117.92700
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    42    80.00000  120.01400
   39    60    43    70.00000  112.02700
   39    60    57    70.00000  112.02700
   39    60    61    35.00000  109.50000
   40    42    43    90.00000  111.18400
   42    40    41    65.00000  121.00000
   42    43    44    35.00000  109.50000
   42    43    45    50.00000  109.50000
   42    43    60    50.00000  109.50000
   43    45    46    37.50000  110.70000
   43    45    47    37.50000  110.70000
   43    45    48    58.35000  112.70000
   43    60    57    58.35000  112.70000
   43    60    61    37.50000  110.70000
   45    43    44    37.50000  110.70000
   45    48    49    63.00000  111.10000
   45    48    51    58.35000  112.70000
   45    48    55    50.00000  109.50000
   47    45    46    33.00000  107.80000
   48    45    46    37.50000  110.70000
   48    45    47    37.50000  110.70000
   48    49    50    80.00000  120.40000
   48    49    57    70.00000  116.00000
   48    51    52    37.50000  110.70000
   48    51    53    37.50000  110.70000
   48    51    54    37.50000  110.70000
   48    55    56    55.00000  108.50000
   49    57    58    35.00000  109.50000
   49    57    59    35.00000  109.50000
   49    57    60    63.00000  111.10000
   57    49    50    80.00000  120.40000
   57    60    61    37.50000  110.70000
   59    57    58    33.00000  107.80000
   60    39    40    70.00000  124.00000
   60    43    44    37.50000  110.70000
   60    43    45    58.35000  112.70000
   60    57    58    37.50000  110.70000
   60    57    59    37.50000  110.70000
   51    48    49    63.00000  111.10000
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    33.00000  107.80000
   55    48    49    90.00000  109.61100
   55    48    51    50.00000  109.50000
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  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    60   0.30250  1.0 1.0
   29    33    39    60  -0.14950 -1.0 2.0
   29    33    39    60   0.36900  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    42   7.00000 -1.0 2.0
   33    39    60    43   0.46850  1.0 1.0
   33    39    60    43   0.08550 -1.0 2.0
   33    39    60    43   0.09800  1.0 3.0
   33    39    60    57   0.46850  1.0 1.0
   33    39    60    57   0.08550 -1.0 2.0
   33    39    60    57   0.09800  1.0 3.0
   33    39    60    61   0.34800  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    60   0.34800  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    60   0.34800  1.0 3.0
   39    40   -42    43  -2.26850  1.0 1.0
   39    40   -42    43   3.39050 -1.0 2.0
   40    39   -60    43   0.09850  1.0 1.0
   40    39   -60    43   0.15250 -1.0 2.0
   40    39   -60    43  -0.50650  1.0 3.0
   40    39    60    57   0.09850  1.0 1.0
   40    39    60    57   0.15250 -1.0 2.0
   40    39    60    57  -0.50650  1.0 3.0
   40    39    60    61   0.00000  1.0 1.0
   40    42    43    44   0.08050  1.0 3.0
   40    42    43    45  -0.46850  1.0 1.0
   40    42    43    45   0.09300 -1.0 2.0
   40    42    43    45  -0.12850  1.0 3.0
   40    42   -43    60  -0.46850  1.0 1.0
   40    42   -43    60   0.09300 -1.0 2.0
   40    42   -43    60  -0.12850  1.0 3.0
   41    40    42    43   2.00000 -1.0 2.0
   42    43    45    46   0.23400  1.0 3.0
   42    43    45    47   0.23400  1.0 3.0
   42    43    45    48   0.62750  1.0 1.0
   42    43    45    48  -0.30950 -1.0 2.0
   42    43    45    48   0.27300  1.0 3.0
   42    43   -60    39   0.61850  1.0 1.0
   42    43   -60    39  -0.22750 -1.0 2.0
   42    43   -60    39   0.15300  1.0 3.0
   42    43    60    57   0.62750  1.0 1.0
   42    43    60    57  -0.30950 -1.0 2.0
   42    43    60    57   0.27300  1.0 3.0
   42    43    60    61   0.23400  1.0 3.0
   43    45    48    49  -0.95700  1.0 1.0
   43    45    48    49  -0.18200 -1.0 2.0
   43    45    48    49   0.29450  1.0 3.0
   43    45    48    51   0.56750  1.0 1.0
   43    45    48    51  -0.07550 -1.0 2.0
   43    45    48    51   0.20000  1.0 3.0
   43    45    48    55   0.86500  1.0 1.0
   43    45    48    55  -0.17500 -1.0 2.0
   43    45    48    55   0.20800  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    47   0.15000  1.0 3.0
   44    43    45    48   0.15000  1.0 3.0
   44    43    60    39   0.15000  1.0 3.0
   44    43    60    57   0.15000  1.0 3.0
   44    43    60    61   0.15000  1.0 3.0
   45    43    60    39   0.34400  1.0 1.0
   45    43    60    39   0.09450 -1.0 2.0
   45    43    60    39   0.11100  1.0 3.0
   45    43    60    57   0.56750  1.0 1.0
   45    43    60    57  -0.07550 -1.0 2.0
   45    43    60    57   0.20000  1.0 3.0
   45    43    60    61   0.15000  1.0 3.0
   45    48    49    50   0.30150 -1.0 2.0
   45    48   -49    57   0.60050  1.0 1.0
   45    48   -49    57   0.05600 -1.0 2.0
   45    48   -49    57   0.26150  1.0 3.0
   45    48    51    52   0.15000  1.0 3.0
   45    48    51    53   0.15000  1.0 3.0
   45    48    51    54   0.15000  1.0 3.0
   45    48    55    56  -0.11600  1.0 1.0
   45    48    55    56  -0.09450 -1.0 2.0
   45    48    55    56   0.21250  1.0 3.0
   46    45    48    49  -0.11250  1.0 3.0
   46    45    48    51   0.15000  1.0 3.0
   46    45    48    55   0.23400  1.0 3.0
   47    45    48    49  -0.11250  1.0 3.0
   47    45    48    51   0.15000  1.0 3.0
   47    45    48    55   0.23400  1.0 3.0
   48    49    57    58   0.00000  1.0 1.0
   48    49    57    59   0.00000  1.0 1.0
   48    49    57    60   0.60050  1.0 1.0
   48    49    57    60   0.05600 -1.0 2.0
   48    49    57    60   0.26150  1.0 3.0
   49    48    51    52  -0.11250  1.0 3.0
   49    48    51    53  -0.11250  1.0 3.0
   49    48    51    54  -0.11250  1.0 3.0
   49    48    55    56   0.91850  1.0 1.0
   49    48    55    56   0.57950  1.0 3.0
   49    57    60    39  -0.98800  1.0 1.0
   49    57    60    39   0.48800 -1.0 2.0
   49    57    60    39   0.76800  1.0 3.0
   49    57   -60    43  -0.95700  1.0 1.0
   49    57   -60    43  -0.18200 -1.0 2.0
   49    57   -60    43   0.29450  1.0 3.0
   49    57    60    61  -0.11250  1.0 3.0
   50    49    57    58   0.00000  1.0 1.0
   50    49    57    59   0.00000  1.0 1.0
   50    49    57    60   0.30150 -1.0 2.0
   58    57    60    39   0.15000  1.0 3.0
   58    57    60    43   0.15000  1.0 3.0
   58    57    60    61   0.15000  1.0 3.0
   59    57    60    39   0.15000  1.0 3.0
   59    57    60    43   0.15000  1.0 3.0
   59    57    60    61   0.15000  1.0 3.0
   60    39    40    41   7.00000 -1.0 2.0
   60    39   -40    42   7.00000 -1.0 2.0
   60    43    45    46   0.15000  1.0 3.0
   60    43    45    47   0.15000  1.0 3.0
   60    43   -45    48   0.56750  1.0 1.0
   60    43   -45    48  -0.07550 -1.0 2.0
   60    43   -45    48   0.20000  1.0 3.0
   51    48    49    50   0.30150 -1.0 2.0
   51    48    49    57   0.60050  1.0 1.0
   51    48    49    57   0.05600 -1.0 2.0
   51    48    49    57   0.26150  1.0 3.0
   51    48    55    56  -0.11600  1.0 1.0
   51    48    55    56  -0.09450 -1.0 2.0
   51    48    55    56   0.21250  1.0 3.0
   55    48    49    50   0.30150 -1.0 2.0
   55    48    49    57   0.55300  1.0 1.0
   55    48    49    57   1.25850 -1.0 2.0
   55    48    49    57  -0.23600  1.0 3.0
   55    48    51    52   0.23400  1.0 3.0
   55    48    51    53   0.23400  1.0 3.0
   55    48    51    54   0.23400  1.0 3.0
IPHI
    9     5     7     8  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
   38    30    36    37  10.50000 -1.0 2.0
   33    60    39    40   1.10000 -1.0 2.0
   41    42    40    39   1.10000 -1.0 2.0
   48    57    49    50  10.50000 -1.0 2.0
END
