* LIGAND DATABASE FILE (OPLS2005)
*
001      61    62    113    172     331
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02080   104.21253   -35.46141
    3     1 S   H    _H1_     3     1.02137    69.11938    69.44717
    4     1 S   H    _H2_     4     1.02113    43.95372  -137.79501
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08610   110.54789    58.81774
   26    24 S   HC   HB22    34     1.08575   109.90351   179.04879
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C12    36     1.82564    98.07424   161.85804
   34    33 S   HC   _H3_    37     1.09985   104.31107   -57.55109
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CT   _C11    38     1.54213   113.03853    59.99335
   39    38 S   HC   _H22    39     1.09913   106.16975   -65.59449
   40    38 S   CM   _C5_    40     1.51676   111.66073   174.30625
   41    40 S   CM   _C4_    41     1.34925   120.68794   -15.05054
   42    40 S   CT   _C8_    53     1.50891   113.28939   169.53721
   43    42 S   HC   _H17    54     1.09679   109.33684   135.20674
   44    42 S   HC   _H18    55     1.09439   111.24713  -105.05389
   45    41 S   CT   _C10    42     1.52118   122.60164    -3.66485
   46    45 S   HC   _H21    43     1.10267   107.44431   109.86641
   47    41 S   CO4  _C7_    50     1.47139   119.39150   174.59282
   48    47 S   O    _O13    51     1.22062   122.32916  -150.05315
   49    47 S   HC   _H16    52     1.10005   114.76381    29.99843
   50    42 S   CT   _C9_    56     1.52879   110.39471    17.14324
   51    50 S   HC   _H19    57     1.09536   109.98252   158.42223
   52    50 S   HC   _H20    58     1.09660   112.14757   -82.71630
   53    33 S   NT   _N11    44     1.45980   111.45798  -173.92449
   54    53 S   H    _H27    45     1.01959   109.52832    49.21986
   55    45 S   CT   _C13    46     1.53562   112.72350  -130.91348
   56    55 S   HC   _H24    47     1.08667   109.44849    61.25975
   57    55 S   HC   _H25    48     1.08661   109.45595   -58.73173
   58    55 S   HC   _H26    49     1.08631   109.42502  -178.78356
   59    50 S   OS   _O14    59     1.44356   111.13358    39.20475
   60    38 S   CO4  _C6_    60     1.52758   117.84658    55.57557
   61    60 S   O    _O33    61     1.22495   124.77373    -0.82945
  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
  14   7   2   1   1  14   7  17  16   9   5   4  10   7   4   1
   1   5   3   2   6   1   3   2   1   1   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    53    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    53    54    60  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    45    46    53    54    55    42    59    60    61  
   38    39    40    45    53    54    60  
   36    37  
   37  
    0  
   39    40    41    45    53    54    47    42    43    44    50    59    60    61  
   40    41    53    42    59    60    61  
   41    45    46    53    55    47    48    49    42    43    44    50    51    52    59    60    61  
   45    46    53    54    55    56    57    58    47    48    49    42    43    44    50    60  
   43    44    50    51    52    59    60    45    47  
   44    50    51    52    59  
   50    51    52    59  
   46    53    54    55    56    57    58    47    48    49  
   53    54    55    56    57    58    47  
   48    49    53    55  
   49  
    0  
   51    52    59    60    61  
   52    59    60  
   59    60  
   54    55    56    57    58    60  
   55  
   56    57    58  
   57    58  
   58  
    0  
   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   0.307500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0150   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   49   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   50   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   53   3.3000   0.1700  -0.780000   1.8650   1.6500   0.051222218  -2.220205820
   54   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   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   1.5900   1.4000   0.020110767  -0.896042159
   60   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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    53   382.000  1.448
   38    39   340.000  1.090
   38    40   317.000  1.510
   38    60   317.000  1.522
   40    41   549.000  1.340
   40    42   317.000  1.510
   41    45   317.000  1.510
   41    47   320.000  1.462
   45    46   340.000  1.090
   45    53   382.000  1.448
   45    55   268.000  1.529
   53    54   434.000  1.010
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   47    48   570.000  1.229
   47    49   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    59   320.000  1.410
   59    60   214.000  1.327
   60    61   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  111.63000
   29    33    53    85.00000  109.00000
   33    38    39    37.50000  110.70000
   33    38    40    70.00000  112.02700
   33    38    60    63.00000  111.10000
   33    53    45    51.80000  107.20000
   33    53    54    35.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    70.00000  124.00000
   38    40    42    65.00000  117.92700
   38    60    59    81.00000  111.40000
   38    60    61    80.00000  120.40000
   40    38    39    35.00000  109.50000
   40    41    45    70.00000  124.00000
   40    41    47    65.00000  118.96000
   40    42    43    35.00000  109.50000
   40    42    44    35.00000  109.50000
   40    42    50    70.00000  112.02700
   41    45    46    35.00000  109.50000
   41    45    53    75.00000  110.70900
   41    45    55    70.00000  112.02700
   41    47    48    80.00000  123.72100
   41    47    49    40.00000  115.75000
   45    53    54    35.00000  109.50000
   45    55    56    37.50000  110.70000
   45    55    57    37.50000  110.70000
   45    55    58    37.50000  110.70000
   53    33    34    35.00000  109.50000
   53    33    38    56.20000  109.47000
   53    45    46    35.00000  109.50000
   55    45    46    37.50000  110.70000
   55    45    53    56.20000  109.47000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   47    41    45    65.00000  116.34900
   49    47    48    35.00000  123.00000
   42    40    41    70.00000  124.00000
   42    50    51    37.50000  110.70000
   42    50    52    37.50000  110.70000
   42    50    59    50.00000  109.50000
   44    42    43    33.00000  107.80000
   50    42    43    37.50000  110.70000
   50    42    44    37.50000  110.70000
   50    59    60    83.00000  116.90000
   52    50    51    33.00000  107.80000
   59    50    51    35.00000  109.50000
   59    50    52    35.00000  109.50000
   59    60    61    83.00000  123.40000
   60    38    39    35.00000  109.50000
   60    38    40    70.00000  109.06800
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    53   0.01700  1.0 1.0
   24    29    33    53  -0.23550 -1.0 2.0
   24    29    33    53   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   0.56750  1.0 1.0
   29    33    38    40  -0.07550 -1.0 2.0
   29    33    38    40   0.20000  1.0 3.0
   29    33    38    60   0.56750  1.0 1.0
   29    33    38    60  -0.07550 -1.0 2.0
   29    33    38    60   0.20000  1.0 3.0
   29    33    53    45   0.23200  1.0 1.0
   29    33    53    45   0.02100 -1.0 2.0
   29    33    53    45   0.24950  1.0 3.0
   29    33    53    54  -0.05900  1.0 1.0
   29    33    53    54   0.08350 -1.0 2.0
   29    33    53    54   0.12500  1.0 3.0
   33    38    40    41   0.09850  1.0 1.0
   33    38    40    41   0.15250 -1.0 2.0
   33    38    40    41  -0.50650  1.0 3.0
   33    38    40    42   0.46850  1.0 1.0
   33    38    40    42   0.08550 -1.0 2.0
   33    38    40    42   0.09800  1.0 3.0
   33    38    60    59   0.36750  1.0 3.0
   33    38    60    61   0.30150 -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    60  -0.11250  1.0 3.0
   34    33    53    45   0.28000  1.0 3.0
   34    33    53    54   0.20000  1.0 3.0
   38    33    53    45   0.23450  1.0 1.0
   38    33    53    45   0.02050 -1.0 2.0
   38    33    53    45   0.25250  1.0 3.0
   38    33    53    54  -0.15950  1.0 1.0
   38    33    53    54   0.34650 -1.0 2.0
   38    33    53    54   0.05750  1.0 3.0
   38    40   -41    45   7.00000 -1.0 2.0
   38    40    41    47   7.00000 -1.0 2.0
   38    40    42    43   0.34800  1.0 3.0
   38    40    42    44   0.34800  1.0 3.0
   38    40    42    50   0.46850  1.0 1.0
   38    40    42    50   0.08550 -1.0 2.0
   38    40    42    50   0.09800  1.0 3.0
   39    38    40    41   0.00000  1.0 1.0
   39    38    40    42   0.34800  1.0 3.0
   39    38    60    59   0.00000  1.0 1.0
   39    38    60    61   0.00000  1.0 1.0
   40    38    60    59   0.40000  1.0 3.0
   40    38    60    61   0.30150 -1.0 2.0
   40    41    45    46   0.00000  1.0 1.0
   40    41    45    53   0.90200  1.0 1.0
   40    41    45    53   0.57900 -1.0 2.0
   40    41    45    53  -0.62100  1.0 3.0
   40    41    45    55   0.09850  1.0 1.0
   40    41    45    55   0.15250 -1.0 2.0
   40    41    45    55  -0.50650  1.0 3.0
   40    41    47    48   1.00000 -1.0 2.0
   40    41    47    49  -0.79650  1.0 1.0
   40    41    47    49   1.60950 -1.0 2.0
   40    41    47    49  -0.26250  1.0 3.0
   40    42    50    51   0.15000  1.0 3.0
   40    42    50    52   0.15000  1.0 3.0
   40    42   -50    59   0.61850  1.0 1.0
   40    42   -50    59  -0.22750 -1.0 2.0
   40    42   -50    59   0.15300  1.0 3.0
   41    40    42    43   0.00000  1.0 1.0
   41    40    42    44   0.00000  1.0 1.0
   41    40    42    50   0.09850  1.0 1.0
   41    40    42    50   0.15250 -1.0 2.0
   41    40    42    50  -0.50650  1.0 3.0
   41    45   -53    33  -0.60800  1.0 1.0
   41    45   -53    33   1.10050 -1.0 2.0
   41    45   -53    33   0.47000  1.0 3.0
   41    45    53    54   0.12450  1.0 1.0
   41    45    53    54  -0.40750 -1.0 2.0
   41    45    53    54   0.30300  1.0 3.0
   41    45    55    56   0.15000  1.0 3.0
   41    45    55    57   0.15000  1.0 3.0
   41    45    55    58   0.15000  1.0 3.0
   45    41    47    48  -0.64400  1.0 1.0
   45    41    47    48   0.26850 -1.0 2.0
   45    41    47    49  -0.07900  1.0 1.0
   45    41    47    49   0.77700 -1.0 2.0
   45    41    47    49   0.13200  1.0 3.0
   46    45    53    33   0.28000  1.0 3.0
   46    45    53    54   0.20000  1.0 3.0
   46    45    55    56   0.15000  1.0 3.0
   46    45    55    57   0.15000  1.0 3.0
   46    45    55    58   0.15000  1.0 3.0
   53    33    38    39   0.15000  1.0 3.0
   53    33   -38    40   0.59950  1.0 1.0
   53    33   -38    40  -0.21400 -1.0 2.0
   53    33   -38    40   0.56200  1.0 3.0
   53    33    38    60  -3.56550  1.0 1.0
   53    33    38    60  -0.67500 -1.0 2.0
   53    33    38    60   1.11300  1.0 3.0
   53    45    55    56   0.15000  1.0 3.0
   53    45    55    57   0.15000  1.0 3.0
   53    45    55    58   0.15000  1.0 3.0
   55    45    53    33   0.23450  1.0 1.0
   55    45    53    33   0.02050 -1.0 2.0
   55    45    53    33   0.25250  1.0 3.0
   55    45    53    54  -0.05950  1.0 1.0
   55    45    53    54   0.08850 -1.0 2.0
   55    45    53    54   0.11750  1.0 3.0
   47    41    45    46   0.15000  1.0 3.0
   47    41    45    53   0.09700  1.0 1.0
   47    41    45    53   0.15600 -1.0 2.0
   47    41    45    53  -0.50800  1.0 3.0
   47    41    45    55   0.09700  1.0 1.0
   47    41    45    55   0.15600 -1.0 2.0
   47    41    45    55  -0.50800  1.0 3.0
   42    40    41    45   7.00000 -1.0 2.0
   42    40    41    47   7.00000 -1.0 2.0
   42    50    59    60  -0.25900  1.0 1.0
   42    50    59    60  -0.47000 -1.0 2.0
   42    50    59    60   0.11750  1.0 3.0
   43    42    50    51   0.15000  1.0 3.0
   43    42    50    52   0.15000  1.0 3.0
   43    42    50    59   0.23400  1.0 3.0
   44    42    50    51   0.15000  1.0 3.0
   44    42    50    52   0.15000  1.0 3.0
   44    42    50    59   0.23400  1.0 3.0
   50    59   -60    38   1.63150  1.0 1.0
   50    59   -60    38   2.92000 -1.0 2.0
   50    59    60    61   3.00000 -1.0 2.0
   51    50    59    60   0.08050  1.0 3.0
   52    50    59    60   0.08050  1.0 3.0
   60    38    40    41  -0.51250  1.0 1.0
   60    38    40    41  -0.88800 -1.0 2.0
   60    38    40    41   0.08850  1.0 3.0
   60    38   -40    42   0.17250  1.0 1.0
   60    38   -40    42  -0.04100 -1.0 2.0
   60    38   -40    42  -0.33850  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
   37    30    35    36  10.50000 -1.0 2.0
   38    42    40    41   1.10000 -1.0 2.0
   47    45    41    40   1.10000 -1.0 2.0
   41    49    47    48  10.50000 -1.0 2.0
   38    59    60    61  10.50000 -1.0 2.0
END
