* LIGAND DATABASE FILE (OPLS2005)
*
001      62    61    109    160     320
    1     0 S   NP   _N1_     1    28.12139    95.58888   -24.85985
    2     1 S   H    _HN1     2     1.02777   114.83763  -112.64112
    3     1 S   H    _H1_     3     1.02957    83.05059    -5.61098
    4     1 S   H    _H2_     4     1.02835    24.10932   169.22468
    5     1 S   CT   _CA1     5     1.50165   123.11852   104.23049
    6     5 S   HC   _HA1     6     1.09575   105.17809    82.55167
    7     5 S   CO3  _C1_     7     1.53760   112.28244   -37.58348
    8     7 S   O2Z  _O11     8     1.26372   114.98250   -44.50409
    9     7 S   O2Z  _O12     9     1.26222   114.92297   134.35959
   10     5 S   CT   _CB1    10     1.53073   107.39395  -159.57714
   11    10 S   HC   HB11    11     1.09835   109.26993   -50.06332
   12    10 S   HC   HB12    12     1.09814   110.45601    66.45913
   13    10 S   CT   _CG1    13     1.53061   112.74802  -171.09228
   14    13 S   HC   HG11    14     1.09585   110.57904   -66.01298
   15    13 S   HC   HG12    15     1.09660   109.85571    53.23317
   16    13 S   C    _CD1    16     1.51867   112.11808   173.57319
   17    16 S   O    _OE1    17     1.22786   123.21243     5.07289
   18    16 S   N    _N2_    18     1.38567   111.91692  -174.94902
   19    18 S   H    _HN2    19     1.01581   119.20127     3.02472
   20    18 S   CT1  _CA2    20     1.45798   122.65288   177.23176
   21    20 S   HC   _HA2    21     1.09746   108.76735    27.53989
   22    20 S   C    _C2_    22     1.53004   107.22855   -89.35492
   23    22 S   O    _O2_    23     1.22961   123.16663   -25.28038
   24    20 S   CT   _CB2    32     1.53144   112.47046   150.70233
   25    24 S   HC   HB21    33     1.09606   110.38098    53.99062
   26    24 S   HC   HB22    34     1.09457   110.05840   172.83555
   27    22 S   N    _N3_    24     1.38527   112.45298   157.36426
   28    27 S   H    _HN3    25     1.01648   120.31603    -2.42794
   29    24 S   S    _SG2    35     1.82497   111.33412   -66.59942
   30    27 S   CT   _CA3    26     1.45345   122.57631   178.43115
   31    30 S   HC   HA31    27     1.09565   107.92828   -53.36439
   32    30 S   HC   HA32    28     1.09557   107.52936    63.01237
   33    29 S   CT   _C9_    36     1.84928    99.23058  -175.19315
   34    33 S   HC   _H3_    37     1.09679   106.63995   -30.04844
   35    30 S   CO3  _C3_    29     1.52904   114.24427  -175.32257
   36    35 S   O2Z  _O31    30     1.26348   116.04533     0.26614
   37    35 S   O2Z  _O32    31     1.26430   114.41994  -179.78602
   38    33 S   CT   _C8_    38     1.53936   107.84586    86.32270
   39    38 S   HC   _H12    39     1.09645   110.95631   -49.05946
   40    38 S   HC   _H13    40     1.09490   110.62600    69.96806
   41    33 S   CT   _C10    53     1.54895   112.42985  -147.75463
   42    41 S   HC   _H4_    54     1.09775   107.65664  -175.01752
   43    38 S   CO4  _C7_    41     1.52436   113.17767  -167.54234
   44    43 S   O    _O33    42     1.23150   121.72274    25.30654
   45    41 S   CO4  _C11    55     1.52487   113.41809   -56.10864
   46    45 S   O    _O34    56     1.22607   124.60630    84.85175
   47    41 S   CO3  _C13    60     1.54594   115.89144    71.31795
   48    47 S   O2Z  _O38    61     1.26267   116.61629     1.23733
   49    47 S   O2Z  _O37    62     1.26634   114.74240   178.99536
   50    43 S   CT   _C5_    43     1.52805   116.45625  -158.54110
   51    50 S   HC   _H8_    44     1.09611   107.88722    41.19325
   52    45 S   CO3  _C12    57     1.51172   121.31240   -95.14315
   53    52 S   O2Z  _O36    58     1.26750   116.35370   174.05891
   54    52 S   O2Z  _O35    59     1.26632   115.95746    -5.48569
   55    50 S   CT   _C4_    45     1.52636   110.99991   158.99808
   56    55 S   HC   _H5_    46     1.09566   111.52987    63.89316
   57    55 S   HC   _H6_    47     1.09500   110.77479  -175.78351
   58    55 S   HC   _H7_    48     1.09546   110.78691   -55.93717
   59    50 S   CT   _C6_    49     1.52392   109.79235   -77.96345
   60    59 S   HC   _H9_    50     1.09568   111.23912   -59.20153
   61    59 S   HC   _H10    51     1.09505   111.08153    60.40760
   62    59 S   HC   _H11    52     1.09494   110.92886  -179.72305
  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  10   5   4   3
  15   8   2   1   1  12   5   4  10   6  11   4   7   4   3   1
   1   9   8   2   1   1   7   3   2   1   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    41    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    41    42    45    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    44    50    41    42    45    46    52    47    48    49  
   38    39    40    43    41    42    45    47  
   36    37  
   37  
    0  
   39    40    43    44    50    51    55    59    41    42    45    47  
   40    43    44    50    41  
   43    44    50    41  
   42    45    46    52    53    54    47    48    49    43  
   45    46    52    47    48    49  
   44    50    51    55    56    57    58    59    60    61    62  
   50    51    55    59  
   46    52    53    54    47    48    49  
   52    53    54    47  
   48    49    52  
   49  
    0  
   51    55    56    57    58    59    60    61    62  
   55    56    57    58    59    60    61    62  
   53    54  
   54  
    0  
   56    57    58    59    60    61    62  
   57    58    59  
   58    59  
   59  
   60    61    62  
   61    62  
   62  
    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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660  -0.160000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   50   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   53   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.800000   1.7000   1.5000   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   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    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   268.000  1.529
   33    41   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    43   317.000  1.522
   43    44   570.000  1.229
   43    50   317.000  1.522
   50    51   340.000  1.090
   50    55   268.000  1.529
   50    59   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   41    42   340.000  1.090
   41    45   317.000  1.522
   41    47   317.000  1.522
   45    46   570.000  1.229
   45    52   250.000  1.524
   52    53   656.000  1.250
   52    54   656.000  1.250
   47    48   656.000  1.250
   47    49   656.000  1.250
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  111.63000
   29    33    41    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    43    63.00000  111.10000
   33    41    42    37.50000  110.70000
   33    41    45    63.00000  111.10000
   33    41    47    70.00000  109.69300
   38    33    34    37.50000  110.70000
   38    43    44    80.00000  120.40000
   38    43    50    70.00000  116.00000
   40    38    39    33.00000  107.80000
   43    38    39    35.00000  109.50000
   43    38    40    35.00000  109.50000
   43    50    51    35.00000  109.50000
   43    50    55    63.00000  111.10000
   43    50    59    63.00000  111.10000
   50    43    44    80.00000  120.40000
   50    55    56    37.50000  110.70000
   50    55    57    37.50000  110.70000
   50    55    58    37.50000  110.70000
   50    59    60    37.50000  110.70000
   50    59    61    37.50000  110.70000
   50    59    62    37.50000  110.70000
   55    50    51    37.50000  110.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   59    50    51    37.50000  110.70000
   59    50    55    58.35000  112.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   41    33    34    37.50000  110.70000
   41    33    38    58.35000  112.70000
   41    45    46    80.00000  120.40000
   41    45    52    65.00000  114.64000
   41    47    48    70.00000  117.00000
   41    47    49    70.00000  117.00000
   45    41    42    35.00000  109.50000
   45    52    53    85.00000  112.82000
   45    52    54    85.00000  112.82000
   52    45    46    80.00000  120.92000
   54    52    53    80.00000  126.00000
   47    41    42    35.00000  109.50000
   47    41    45    70.00000  107.85200
   49    47    48    80.00000  126.00000
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    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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   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    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    43   0.56750  1.0 1.0
   29    33    38    43  -0.07550 -1.0 2.0
   29    33    38    43   0.20000  1.0 3.0
   29    33    41    42   0.15000  1.0 3.0
   29    33    41    45   0.56750  1.0 1.0
   29    33    41    45  -0.07550 -1.0 2.0
   29    33    41    45   0.20000  1.0 3.0
   29    33    41    47   0.56750  1.0 1.0
   29    33    41    47  -0.07550 -1.0 2.0
   29    33    41    47   0.20000  1.0 3.0
   33    38    43    44   0.30150 -1.0 2.0
   33    38    43    50   0.60050  1.0 1.0
   33    38    43    50   0.05600 -1.0 2.0
   33    38    43    50   0.26150  1.0 3.0
   33    41    45    46   0.30150 -1.0 2.0
   33    41    45    52   0.65300  1.0 1.0
   33    41    45    52  -0.03850 -1.0 2.0
   33    41    45    52   0.33900  1.0 3.0
   33    41    47    48   0.41150 -1.0 2.0
   33    41    47    49   0.41150 -1.0 2.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    43  -0.11250  1.0 3.0
   34    33    41    42   0.15000  1.0 3.0
   34    33    41    45  -0.11250  1.0 3.0
   34    33    41    47  -0.11250  1.0 3.0
   38    33    41    42   0.15000  1.0 3.0
   38    33    41    45  -0.95700  1.0 1.0
   38    33    41    45  -0.18200 -1.0 2.0
   38    33    41    45   0.29450  1.0 3.0
   38    33    41    47  -1.63150  1.0 1.0
   38    33    41    47  -0.43550 -1.0 2.0
   38    33    41    47   0.24500  1.0 3.0
   38    43    50    51   0.00000  1.0 1.0
   38    43    50    55   0.60050  1.0 1.0
   38    43    50    55   0.05600 -1.0 2.0
   38    43    50    55   0.26150  1.0 3.0
   38    43    50    59   0.60050  1.0 1.0
   38    43    50    59   0.05600 -1.0 2.0
   38    43    50    59   0.26150  1.0 3.0
   39    38    43    44   0.00000  1.0 1.0
   39    38    43    50   0.00000  1.0 1.0
   40    38    43    44   0.00000  1.0 1.0
   40    38    43    50   0.00000  1.0 1.0
   43    50    55    56  -0.11250  1.0 3.0
   43    50    55    57  -0.11250  1.0 3.0
   43    50    55    58  -0.11250  1.0 3.0
   43    50    59    60  -0.11250  1.0 3.0
   43    50    59    61  -0.11250  1.0 3.0
   43    50    59    62  -0.11250  1.0 3.0
   44    43    50    51   0.00000  1.0 1.0
   44    43    50    55   0.30150 -1.0 2.0
   44    43    50    59   0.30150 -1.0 2.0
   51    50    55    56   0.15000  1.0 3.0
   51    50    55    57   0.15000  1.0 3.0
   51    50    55    58   0.15000  1.0 3.0
   51    50    59    60   0.15000  1.0 3.0
   51    50    59    61   0.15000  1.0 3.0
   51    50    59    62   0.15000  1.0 3.0
   55    50    59    60   0.15000  1.0 3.0
   55    50    59    61   0.15000  1.0 3.0
   55    50    59    62   0.15000  1.0 3.0
   59    50    55    56   0.15000  1.0 3.0
   59    50    55    57   0.15000  1.0 3.0
   59    50    55    58   0.15000  1.0 3.0
   41    33    38    39   0.15000  1.0 3.0
   41    33    38    40   0.15000  1.0 3.0
   41    33    38    43  -0.95700  1.0 1.0
   41    33    38    43  -0.18200 -1.0 2.0
   41    33    38    43   0.29450  1.0 3.0
   41    45    52    53   0.49600 -1.0 2.0
   41    45    52    54   0.49600 -1.0 2.0
   42    41    45    46   0.00000  1.0 1.0
   42    41    45    52   0.00000  1.0 1.0
   42    41    47    48   0.00000  1.0 1.0
   42    41    47    49   0.00000  1.0 1.0
   45    41    47    48   0.30150 -1.0 2.0
   45    41    47    49   0.30150 -1.0 2.0
   46    45    52    53   0.06100 -1.0 2.0
   46    45    52    54   0.06100 -1.0 2.0
   47    41    45    46   0.30150 -1.0 2.0
   47    41    45    52   0.65300  1.0 1.0
   47    41    45    52  -0.03850 -1.0 2.0
   47    41    45    52   0.33900  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    50    43    44  10.50000 -1.0 2.0
   41    52    45    46  10.50000 -1.0 2.0
   53    45    52    54  10.50000 -1.0 2.0
   48    41    47    49  10.50000 -1.0 2.0
END
