* LIGAND DATABASE FILE (OPLS2005)
*
001      71    72    130    198     373
    1     0 S   NP   _N1_     1    28.08493    97.23178   -22.39427
    2     1 S   H    _HN1     2     1.02772   104.34579  -124.53381
    3     1 S   H    _H1_     3     1.02947    73.72669   -19.25360
    4     1 S   H    _H2_     4     1.02829    37.01490   134.65860
    5     1 S   CT   _CA1     5     1.50180   138.84658    83.32199
    6     5 S   HC   _HA1     6     1.09576   105.17470    89.69787
    7     5 S   CO3  _C1_     7     1.53805   111.95724   -30.38849
    8     7 S   O2Z  _O11     8     1.26382   115.00090   -50.32866
    9     7 S   O2Z  _O12     9     1.26204   114.92290   128.15418
   10     5 S   CT   _CB1    10     1.53059   107.32495  -152.51687
   11    10 S   HC   HB11    11     1.09840   109.43371   -49.18191
   12    10 S   HC   HB12    12     1.09806   110.47886    67.39180
   13    10 S   CT   _CG1    13     1.53021   112.62170  -170.07619
   14    13 S   HC   HG11    14     1.09591   110.65516   -64.32304
   15    13 S   HC   HG12    15     1.09657   109.82402    54.89431
   16    13 S   C    _CD1    16     1.51874   111.96032   175.39836
   17    16 S   O    _OE1    17     1.22801   123.24231     8.39368
   18    16 S   N    _N2_    18     1.38431   111.94348  -172.03454
   19    18 S   H    _HN2    19     1.01922   119.10425     2.16907
   20    18 S   CT1  _CA2    20     1.45832   122.86734   179.45356
   21    20 S   HC   _HA2    21     1.09746   108.63666    30.54989
   22    20 S   C    _C2_    22     1.52988   107.54684   -86.60951
   23    22 S   O    _O2_    23     1.22949   123.24144   -25.51747
   24    20 S   CT   _CB2    32     1.53261   111.96187   153.53669
   25    24 S   HC   HB21    33     1.09309   109.39890    56.49781
   26    24 S   HC   HB22    34     1.09514   110.44251   174.68640
   27    22 S   N    _N3_    24     1.38551   112.41945   157.10021
   28    27 S   H    _HN3    25     1.01644   120.32259    -2.19874
   29    24 S   S    _SG2    35     1.82820   110.79414   -65.98800
   30    27 S   CT   _CA3    26     1.45347   122.52874   178.59250
   31    30 S   HC   HA31    27     1.09564   107.85302   -55.18984
   32    30 S   HC   HA32    28     1.09561   107.58351    61.16505
   33    29 S   CT   _C11    36     1.87389   102.06055   152.31596
   34    30 S   CO3  _C3_    29     1.52899   114.27724  -177.07886
   35    34 S   O2Z  _O31    30     1.26346   116.04764     1.10411
   36    34 S   O2Z  _O32    31     1.26436   114.42434  -178.94649
   37    33 S   CT   _C9_    37     1.55902   104.60425   176.54249
   38    37 S   HC   _H5_    38     1.09644   110.91269   -58.20165
   39    37 S   HC   _H6_    39     1.09544   111.46026    60.15404
   40    33 S   CT   _C14    62     1.55708   108.50842    58.14533
   41    40 S   HC   _H13    63     1.09632   111.29237   -60.43881
   42    40 S   HC   _H14    64     1.09643   110.67053  -179.01245
   43    37 S   S    _S1_    40     1.83350   114.50787  -178.08725
   44    40 S   OS   _O4_    65     1.43924   110.82663    61.09846
   45    43 S   C4T  _C10    41     1.82367    96.36508   -57.66166
   46    45 S   HC   _H7_    42     1.09449   114.40474   -78.69924
   47    44 S   CO4  _C8_    66     1.36201   115.74406   179.15628
   48    47 S   O    _O3_    67     1.22326   126.27505    -0.44762
   49    45 S   C4T  _C4_    43     1.55535   116.16103   145.17483
   50    49 S   HC   _H4_    44     1.09664   113.06191   137.32532
   51    45 S   N4   _N6_    47     1.45405   109.20824    49.13410
   52    47 S   CT   _C12    68     1.49818   109.54900   179.61641
   53    52 S   HC   _H8_    69     1.09292   109.82300   -60.88101
   54    52 S   HC   _H9_    70     1.09377   109.36487  -179.92598
   55    52 S   HC   _H10    71     1.09290   109.82244    61.01678
   56    49 S   C4   _C5_    45     1.55251    85.28415  -109.85487
   57    56 S   O    _O1_    46     1.20895   136.68329   177.98433
   58    33 S   CT1  _C15    48     1.56135   111.73747   -62.69956
   59    58 S   HC   _H15    49     1.09835   108.67884    80.70812
   60    49 S   N    _N4_    53     1.47901   117.43706     5.11719
   61    60 S   H    _H3_    54     1.01758   118.96812    -3.98949
   62    58 S   CO3  _C16    50     1.54955   116.31734   -39.21520
   63    62 S   O2Z  _O5_    51     1.26565   114.62578   114.28670
   64    62 S   O2Z  _O6_    52     1.26238   116.08090   -65.76250
   65    60 S   C    _C7_    55     1.38831   122.58541   177.00004
   66    65 S   O    _O33    56     1.22788   124.27767    -0.69210
   67    65 S   CT   _C13    57     1.51401   111.98946   178.93247
   68    67 S   HC   _H11    58     1.09594   108.62848    53.19104
   69    67 S   HC   _H12    59     1.09581   108.20029   -63.57527
   70    67 S   CZ   _C6_    60     1.46597   112.35728   174.79346
   71    70 S   NZ   _N5_    61     1.16049   179.26140  -173.65616
  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  13   5   4   3
  17   2   1   1  14   5   4  11   4   3   8   7  12   6   5   4
  10   6   8   3   2   1   1   7   2   4   3   7   3   2   1   1
   6   4   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    58    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    43    51    58    59    62    40    41    42    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    45    56    51    58    59    62    63    64    40    41    42    44    47  
   35    36  
   36  
    0  
   38    39    43    45    46    49    51    58    59    62    40    41    42    44  
   39    43    45    58    40  
   43    45    58    40  
   41    42    44    47    48    52    43    51    58    59    62  
   42    44    47    58  
   44    47    58  
   45    46    49    50    56    51    58    60  
   47    48    52    53    54    55    58  
   46    49    50    56    57    51    58    59    62    60    61    65  
   49    50    56    51    58    60  
   48    52    53    54    55  
   52    53    54    55  
   50    56    57    51    58    60    61    65    66    67  
   56    57    51    60    61    65  
   58    59    62    63    64    60    56    57  
   53    54    55  
   54    55  
   55  
    0  
   57    58    59    62    60    61    65  
   58    60  
   59    62    63    64  
   62    63    64  
   61    65    66    67    68    69    70  
   65    66    67  
   63    64  
   64  
    0  
   66    67    68    69    70    71  
   67    68    69    70  
   68    69    70    71  
   69    70    71  
   70    71  
   71  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   42   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   43   3.6000   0.3550  -0.324000   2.0300   1.8000   0.025682759  -1.666211680
   44   3.0000   0.1700  -0.330000   1.5900   1.4000   0.020110767  -0.896042159
   45   3.5000   0.0660   0.219000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   49   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.2500   0.1700  -0.445000   1.8100   1.6000   0.054801302  -1.445846770
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   54   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   56   3.7500   0.1050   0.629000   1.9250   1.7000   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.506500   1.5250   1.4250   0.001000000  -1.480495490
   58   3.5000   0.0660   0.040000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   61   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   62   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   64   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   65   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   66   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   67   3.3000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.3000   0.0660   0.460000   2.0580   1.8250   0.025318638  -1.264311570
   71   3.2800   0.1700  -0.560000   2.2500   2.0000   0.024786691  -1.117108600
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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   268.000  1.529
   33    58   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    43   222.000  1.810
   43    45   200.000  1.824
   45    46   340.000  1.090
   45    49   268.000  1.529
   45    51   305.000  1.456
   49    50   340.000  1.090
   49    56   250.000  1.540
   49    60   337.000  1.449
   56    57   930.000  1.212
   56    51   440.000  1.369
   51    58   337.000  1.449
   58    59   340.000  1.090
   58    62   317.000  1.522
   62    63   656.000  1.250
   62    64   656.000  1.250
   60    61   434.000  1.010
   60    65   490.000  1.335
   65    66   570.000  1.229
   65    67   317.000  1.522
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   390.000  1.470
   70    71   650.000  1.157
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    44   320.000  1.410
   44    47   214.000  1.327
   47    48   570.000  1.229
   47    52   317.000  1.522
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  111.63000
   29    33    58    75.00000  108.68000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    43    75.00000  111.63000
   33    58    51    80.00000  109.70000
   33    58    59    37.50000  110.70000
   33    58    62    63.00000  111.10000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    44    50.00000  109.50000
   37    43    45    85.00000   99.86700
   39    37    38    33.00000  107.80000
   43    37    38    35.00000  109.50000
   43    37    39    35.00000  109.50000
   43    45    46    45.00000  109.41400
   43    45    49    65.00000  119.05700
   43    45    51    80.00000  108.62000
   45    49    50    37.50000  110.70000
   45    49    56   100.00000   86.36000
   45    49    60    80.00000  110.05700
   45    51    56   100.00000   93.00000
   45    51    58    50.00000  132.70000
   49    45    46    37.50000  110.70000
   49    56    57    60.00000  136.58000
   49    56    51    95.00000   92.72400
   49    60    61    38.00000  118.40000
   49    60    65    50.00000  121.90000
   56    49    50    40.00000  113.37500
   56    51    58    50.00000  132.10000
   51    45    46    50.00000  112.01000
   51    45    49   105.00000   87.49700
   51    56    57    75.00000  131.60000
   51    58    59    35.00000  109.50000
   51    58    62    63.00000  110.10000
   58    33    37    58.35000  112.70000
   58    62    63    70.00000  117.00000
   58    62    64    70.00000  117.00000
   62    58    59    35.00000  109.50000
   64    62    63    80.00000  126.00000
   60    49    50    50.00000  112.01000
   60    49    56    75.00000  110.24000
   60    65    66    80.00000  122.90000
   60    65    67    70.00000  116.60000
   65    60    61    35.00000  119.80000
   65    67    68    35.00000  109.50000
   65    67    69    35.00000  109.50000
   65    67    70    70.00000  111.78000
   67    65    66    80.00000  120.40000
   67    70    71   150.00000  180.00000
   69    67    68    33.00000  107.80000
   70    67    68    35.00000  108.50000
   70    67    69    35.00000  108.50000
   40    33    37    58.35000  112.70000
   40    33    58    58.35000  112.70000
   40    44    47    83.00000  116.90000
   42    40    41    33.00000  107.80000
   44    40    41    35.00000  109.50000
   44    40    42    35.00000  109.50000
   44    47    48    83.00000  123.40000
   44    47    52    81.00000  111.40000
   47    52    53    35.00000  109.50000
   47    52    54    35.00000  109.50000
   47    52    55    35.00000  109.50000
   52    47    48    80.00000  120.40000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    58   0.01700  1.0 1.0
   24    29    33    58  -0.23550 -1.0 2.0
   24    29    33    58   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    43   0.56750  1.0 1.0
   29    33    37    43  -0.07550 -1.0 2.0
   29    33    37    43   0.20000  1.0 3.0
   29    33    58    51   0.71400  1.0 1.0
   29    33    58    51   0.04300 -1.0 2.0
   29    33    58    51   0.01450  1.0 3.0
   29    33    58    59   0.15000  1.0 3.0
   29    33    58    62  -2.17200  1.0 1.0
   29    33    58    62  -0.85700 -1.0 2.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    44   0.56750  1.0 1.0
   29    33    40    44  -0.07550 -1.0 2.0
   29    33    40    44   0.20000  1.0 3.0
   33    37    43    45  -0.25000 -1.0 2.0
   33    37    43    45  -0.01800  1.0 3.0
   33    58    62    63   0.00000  1.0 1.0
   33    58    62    64   0.00000  1.0 1.0
   33    40    44    47  -0.25900  1.0 1.0
   33    40    44    47  -0.47000 -1.0 2.0
   33    40    44    47   0.11750  1.0 3.0
   37    33    58    51   0.42250  1.0 1.0
   37    33    58    51  -0.48100 -1.0 2.0
   37    33    58    51   0.35650  1.0 3.0
   37    33    58    59   0.15000  1.0 3.0
   37    33    58    62  -0.84850  1.0 1.0
   37    33    58    62  -0.22800 -1.0 2.0
   37    33    58    62   0.29250  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    44   0.62750  1.0 1.0
   37    33    40    44  -0.30950 -1.0 2.0
   37    33    40    44   0.27300  1.0 3.0
   37    43    45    46   0.00000  1.0 1.0
   37    43    45    49   0.25150  1.0 1.0
   37    43    45    49  -1.17200 -1.0 2.0
   37    43    45    49   0.53050  1.0 3.0
   37    43   -45    51   0.01700  1.0 1.0
   37    43   -45    51  -0.23550 -1.0 2.0
   37    43   -45    51   0.21350  1.0 3.0
   38    37    43    45   0.32350  1.0 3.0
   39    37    43    45   0.32350  1.0 3.0
   43    45    49    50   0.00000  1.0 1.0
   43    45    49    56   0.00000  1.0 1.0
   43    45    49    60   0.00000  1.0 1.0
   43    45   -51    56   0.00000  1.0 1.0
   43    45    51    58   0.00000  1.0 1.0
   45    49    56    57  -0.11250  1.0 1.0
   45    49    56    57   0.11400 -1.0 2.0
   45    49    56    57  -0.28950  1.0 3.0
   45    49   -56    51   3.00000 -1.0 2.0
   45    49    60    61   0.00000  1.0 1.0
   45    49    60    65  -0.43950  1.0 1.0
   45    49    60    65  -0.08100 -1.0 2.0
   45    49    60    65   0.03350  1.0 3.0
   45    51   -58    33   0.00000  1.0 1.0
   45    51    58    59   0.00000  1.0 1.0
   45    51    58    62   0.00000  1.0 1.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    56   0.15000  1.0 3.0
   46    45    49    60   0.15000  1.0 3.0
   46    45   -51    56   0.00000  1.0 1.0
   46    45    51    58   0.00000  1.0 1.0
   49    45   -51    56   0.00000  1.0 1.0
   49    45    51    58   0.00000  1.0 1.0
   49    56   -51    45   3.00000 -1.0 2.0
   49    56   -51    58   3.00000 -1.0 2.0
   49    60    65    66   3.04450 -1.0 2.0
   49    60    65    67   1.49850  1.0 1.0
   49    60    65    67   1.53950 -1.0 2.0
   50    49    56    57   0.00000  1.0 1.0
   50    49    56    51   0.00000  1.0 1.0
   50    49    60    61   0.00000  1.0 1.0
   50    49    60    65   0.00000  1.0 1.0
   56    49    60    61   0.00000  1.0 1.0
   56    49    60    65  -0.42300  1.0 1.0
   56    49    60    65  -0.07000 -1.0 2.0
   56    49    60    65   0.04150  1.0 3.0
   56    51    58    33   0.00000  1.0 1.0
   56    51    58    59   0.00000  1.0 1.0
   56    51    58    62   0.00000  1.0 1.0
   57    56   -51    45   3.00000 -1.0 2.0
   57    56    51    58   3.00000 -1.0 2.0
   51    45   -49    50   0.15000  1.0 3.0
   51    45   -49    56   3.00000 -1.0 2.0
   51    45    49    60   2.20050  1.0 1.0
   51    45    49    60   0.63450 -1.0 2.0
   51    45    49    60  -0.91300  1.0 3.0
   51    58    62    63   0.00000  1.0 1.0
   51    58    62    64   0.00000  1.0 1.0
   58    33    37    38   0.15000  1.0 3.0
   58    33    37    39   0.15000  1.0 3.0
   58    33   -37    43   0.44750  1.0 1.0
   58    33   -37    43  -0.17800 -1.0 2.0
   58    33   -37    43   0.20200  1.0 3.0
   58    33    40    41   0.15000  1.0 3.0
   58    33    40    42   0.15000  1.0 3.0
   58    33    40    44   0.62750  1.0 1.0
   58    33    40    44  -0.30950 -1.0 2.0
   58    33    40    44   0.27300  1.0 3.0
   59    58    62    63   0.00000  1.0 1.0
   59    58    62    64   0.00000  1.0 1.0
   60    49    56    57   0.30150 -1.0 2.0
   60    49   -56    51   0.00000  1.0 1.0
   60    65    67    68   0.00000  1.0 1.0
   60    65    67    69   0.00000  1.0 1.0
   60    65    67    70   0.00000  1.0 1.0
   61    60    65    66   2.45000 -1.0 2.0
   61    60    65    67   2.45000 -1.0 2.0
   65    67    70    71   0.00000  1.0 1.0
   66    65    67    68   0.00000  1.0 1.0
   66    65    67    69   0.00000  1.0 1.0
   66    65    67    70   0.30150 -1.0 2.0
   68    67    70    71   0.00000  1.0 1.0
   69    67    70    71   0.00000  1.0 1.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    43   0.44750  1.0 1.0
   40    33    37    43  -0.17800 -1.0 2.0
   40    33    37    43   0.20200  1.0 3.0
   40    33    58    51   0.42250  1.0 1.0
   40    33    58    51  -0.48100 -1.0 2.0
   40    33    58    51   0.35650  1.0 3.0
   40    33    58    59   0.15000  1.0 3.0
   40    33    58    62  -0.84850  1.0 1.0
   40    33    58    62  -0.22800 -1.0 2.0
   40    33    58    62   0.29250  1.0 3.0
   40    44    47    48   3.00000 -1.0 2.0
   40    44    47    52   1.63150  1.0 1.0
   40    44    47    52   2.92000 -1.0 2.0
   41    40    44    47   0.08050  1.0 3.0
   42    40    44    47   0.08050  1.0 3.0
   44    47    52    53   0.00000  1.0 1.0
   44    47    52    54   0.00000  1.0 1.0
   44    47    52    55   0.00000  1.0 1.0
   48    47    52    53   0.00000  1.0 1.0
   48    47    52    54   0.00000  1.0 1.0
   48    47    52    55   0.00000  1.0 1.0
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
   36    30    34    35  10.50000 -1.0 2.0
   49    51    56    57  10.50000 -1.0 2.0
   58    56    51    45   1.00000 -1.0 2.0
   63    58    62    64  10.50000 -1.0 2.0
   61    65    60    49   1.00000 -1.0 2.0
   60    67    65    66  10.50000 -1.0 2.0
   44    52    47    48  10.50000 -1.0 2.0
END
