* LIGAND DATABASE FILE (OPLS2005)
*
001      66    66    118    166     337
    1     0 S   NP   _N1_     1    28.13455    95.69717   -22.75425
    2     1 S   H    _HN1     2     1.02776   102.10027  -113.69924
    3     1 S   H    _H1_     3     1.02957    81.36739    -6.66809
    4     1 S   H    _H2_     4     1.02835    30.24576   141.46280
    5     1 S   CT   _CA1     5     1.50132   136.66969   103.97862
    6     5 S   HC   _HA1     6     1.09575   105.20994    78.33172
    7     5 S   CO3  _C1_     7     1.53783   112.35308   -41.84922
    8     7 S   O2Z  _O11     8     1.26367   114.99551   -44.02011
    9     7 S   O2Z  _O12     9     1.26235   114.93103   135.04881
   10     5 S   CT   _CB1    10     1.53093   107.41680  -163.76917
   11    10 S   HC   HB11    11     1.09828   109.32217   -50.47404
   12    10 S   HC   HB12    12     1.09816   110.43517    66.08028
   13    10 S   CT   _CG1    13     1.53020   112.67583  -171.53787
   14    13 S   HC   HG11    14     1.09593   110.49805   -64.64540
   15    13 S   HC   HG12    15     1.09657   109.90809    54.55389
   16    13 S   C    _CD1    16     1.51847   112.30321   174.92032
   17    16 S   O    _OE1    17     1.22756   123.27865     0.97237
   18    16 S   N    _N2_    18     1.38536   111.71622  -179.02422
   19    18 S   H    _HN2    19     1.01560   119.08772     4.16387
   20    18 S   CT1  _CA2    20     1.45846   122.91241   177.91625
   21    20 S   HC   _HA2    21     1.09729   108.91139    24.70822
   22    20 S   C    _C2_    22     1.52944   107.03123   -92.33304
   23    22 S   O    _O2_    23     1.22989   123.06376   -26.69034
   24    20 S   CT   _CB2    32     1.53135   112.17744   147.89742
   25    24 S   HC   HB21    33     1.09547   110.01012    54.11757
   26    24 S   HC   HB22    34     1.09492   110.01748   172.90729
   27    22 S   N    _N3_    24     1.38520   112.57442   155.92483
   28    27 S   H    _HN3    25     1.01661   120.33537    -1.72533
   29    24 S   S    _SG2    35     1.82780   111.07991   -66.69175
   30    27 S   CT   _CA3    26     1.45342   122.44961   178.51615
   31    30 S   HC   HA31    27     1.09572   107.67731   -58.08817
   32    30 S   HC   HA32    28     1.09565   107.71468    58.21130
   33    29 S   CT   _C8_    36     1.85775    99.45002   178.33575
   34    33 S   Cl   Cl1_    37     1.80913   106.25821  -175.00456
   35    30 S   CO3  _C3_    29     1.52887   114.39765  -179.96574
   36    35 S   O2Z  _O31    30     1.26327   116.10788    -2.01528
   37    35 S   O2Z  _O32    31     1.26452   114.39233   178.03099
   38    33 S   NI   _N5_    38     1.45843   113.76369   -57.24988
   39    38 S   CDX  _C7_    39     1.29281   117.99893   144.45112
   40    39 S   NI   _N7_    40     1.37399   121.61163    -0.75017
   41    39 S   NE   _N4_    55     1.37995   122.10274   179.44187
   42    41 S   H    _H10    56     1.01527   116.94589   177.26391
   43    40 S   CDX  _C9_    41     1.29939   120.21538   -10.94107
   44    41 S   CT   _C5_    57     1.45223   125.43732     3.18752
   45    44 S   HC   _H6_    58     1.09644   110.06534   -35.14103
   46    33 S   NM   _N6_    42     1.45071   107.38593    72.05654
   47    43 S   NE   _N8_    43     1.37901   121.01162  -177.30463
   48    47 S   H    _H11    44     1.01604   115.71604     1.56948
   49    44 S   CT   _C4_    59     1.52637   109.13743  -153.40771
   50    49 S   HC   _H3_    60     1.09589   111.46687   -60.64961
   51    49 S   HC   _H4_    61     1.09560   110.71888    59.00693
   52    49 S   HC   _H5_    62     1.09499   110.86292   178.87604
   53    44 S   CT   _C6_    63     1.52513   109.57586    85.11877
   54    53 S   HC   _H7_    64     1.09585   111.34967    58.94633
   55    53 S   HC   _H8_    65     1.09526   111.02000   -60.74402
   56    53 S   HC   _H9_    66     1.09496   110.85581   179.38547
   57    47 S   CT   _C10    45     1.45651   128.31039   175.85664
   58    57 S   HC   _H12    46     1.09620   110.70938    34.76977
   59    57 S   CT   _C11    47     1.52583   109.59919   -86.15215
   60    59 S   HC   _H13    48     1.09589   111.32500   -58.64282
   61    59 S   HC   _H14    49     1.09526   111.15030    61.08613
   62    59 S   HC   _H15    50     1.09500   110.83249  -179.00732
   63    57 S   CT   _C12    51     1.52772   108.93601   152.76205
   64    63 S   HC   _H16    52     1.09589   111.49133    60.58088
   65    63 S   HC   _H17    53     1.09561   110.70016   -59.09673
   66    63 S   HC   _H18    54     1.09500   110.85003  -178.94668
  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
   8   4   2   1   1   7  10   8  12   4   7   9   8   3  11   4
   7   3   2   1   3   2   1   1   9   8   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    46    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    43    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    46    47    41  
   38    39    43    46  
   36    37  
   37  
    0  
   39    40    43    46    41    42    44  
   40    43    46    47    41    42    44    45    49    53  
   43    46    47    48    57    41    42    44  
   42    44    45    49    50    51    52    53    54    55    56    43  
   44    45    49    53  
   46    47    48    57    58    59    63  
   45    49    50    51    52    53    54    55    56  
   49    50    51    52    53    54    55    56  
   47    48    57  
   48    57    58    59    60    61    62    63    64    65    66  
   57    58    59    63  
   50    51    52    53    54    55    56  
   51    52    53  
   52    53  
   53  
   54    55    56  
   55    56  
   56  
    0  
   58    59    60    61    62    63    64    65    66  
   59    60    61    62    63    64    65    66  
   60    61    62    63    64    65    66  
   61    62    63  
   62    63  
   63  
   64    65    66  
   65    66  
   66  
    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  -0.175000   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   0.452500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   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   3.2800   0.1700  -0.481500   1.8540   1.6400   0.005000000   0.000000000
   39   3.7500   0.1050   0.693000   2.1120   1.8750   0.001000000  -0.126889456
   40   3.2800   0.1700  -0.718000   1.8540   1.6400   0.005000000   0.000000000
   41   3.2500   0.1700  -0.507500   1.8650   1.6500   0.051222218  -2.220205820
   42   0.5000   0.0300   0.410000   0.9960   0.8600   0.030040813  -0.651083722
   43   3.7500   0.1050   0.456500   2.1120   1.8750   0.001000000  -0.126889456
   44   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.4200   0.1700  -1.245000   1.9310   1.7100   0.005000000   0.000000000
   47   3.2500   0.1700  -0.507500   1.8650   1.6500   0.051222218  -2.220205820
   48   0.5000   0.0300   0.410000   0.9960   0.8600   0.030040813  -0.651083722
   49   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0150   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
   63   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   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   245.000  1.781
   33    38   315.000  1.435
   33    46   320.000  1.444
   38    39   650.000  1.285
   39    40   630.000  1.388
   39    41   445.000  1.380
   40    43   650.000  1.285
   43    46   430.000  1.365
   43    47   445.000  1.380
   47    48   434.000  1.010
   47    57   382.000  1.448
   57    58   340.000  1.090
   57    59   268.000  1.529
   57    63   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    66   340.000  1.090
   41    42   434.000  1.010
   41    44   382.000  1.448
   44    45   340.000  1.090
   44    49   268.000  1.529
   44    53   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   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    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    85.00000  110.65400
   29    33    38    75.00000  111.34000
   29    33    46    85.00000  109.00000
   33    38    39    75.00000  112.28000
   33    46    43    70.00000  118.22000
   38    33    34    85.00000  105.00000
   38    39    40    75.00000  130.08800
   38    39    41    75.00000  124.36500
   39    40    43    80.00000  112.53000
   39    41    42    35.00000  119.50000
   39    41    44    50.00000  119.50000
   40    43    46    75.00000  125.50000
   40    43    47    75.00000  124.36500
   43    47    48    35.00000  119.50000
   43    47    57    50.00000  119.50000
   46    33    34    85.00000  105.00000
   46    33    38    85.00000  109.00000
   47    43    46    80.00000  117.43000
   47    57    58    35.00000  109.50000
   47    57    59    80.00000  111.61500
   47    57    63    80.00000  111.61500
   57    47    48    35.00000  112.50000
   57    59    60    37.50000  110.70000
   57    59    61    37.50000  110.70000
   57    59    62    37.50000  110.70000
   57    63    64    37.50000  110.70000
   57    63    65    37.50000  110.70000
   57    63    66    37.50000  110.70000
   59    57    58    37.50000  110.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   63    57    58    37.50000  110.70000
   63    57    59    58.35000  112.70000
   65    63    64    33.00000  107.80000
   66    63    64    33.00000  107.80000
   66    63    65    33.00000  107.80000
   41    39    40    75.00000  124.36500
   41    44    45    35.00000  109.50000
   41    44    49    80.00000  111.61500
   41    44    53    80.00000  111.61500
   44    41    42    35.00000  112.50000
   44    49    50    37.50000  110.70000
   44    49    51    37.50000  110.70000
   44    49    52    37.50000  110.70000
   44    53    54    37.50000  110.70000
   44    53    55    37.50000  110.70000
   44    53    56    37.50000  110.70000
   49    44    45    37.50000  110.70000
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   53    44    45    37.50000  110.70000
   53    44    49    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    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    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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  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    46   0.01700  1.0 1.0
   24    29    33    46  -0.23550 -1.0 2.0
   24    29    33    46   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  -0.12500  1.0 1.0
   29    33    38    39  -0.12500 -1.0 2.0
   29    33    38    39   0.25000  1.0 3.0
   29    33    46    43   0.00000  1.0 1.0
   33    38    39    40   6.00000 -1.0 2.0
   33    38    39    41   0.32050  1.0 1.0
   33    38    39    41   8.28000 -1.0 2.0
   34    33    38    39  -0.12500  1.0 1.0
   34    33    38    39  -0.12500 -1.0 2.0
   34    33    38    39   0.25000  1.0 3.0
   34    33    46    43   0.00000  1.0 1.0
   38    33    46    43   0.00000  1.0 1.0
   38    39   -40    43   0.00050  1.0 1.0
   38    39   -40    43   2.00000 -1.0 2.0
   38    39    41    42   1.50000 -1.0 2.0
   38    39    41    44  -0.86000  1.0 1.0
   38    39    41    44   0.84650 -1.0 2.0
   39    40    43    46   6.00000 -1.0 2.0
   39    40    43    47   6.00000 -1.0 2.0
   39    41    44    45   0.00000  1.0 1.0
   39    41    44    49   0.38950  1.0 1.0
   39    41    44    49  -0.47050 -1.0 2.0
   39    41    44    49   0.83150  1.0 3.0
   39    41    44    53   0.38950  1.0 1.0
   39    41    44    53  -0.47050 -1.0 2.0
   39    41    44    53   0.83150  1.0 3.0
   40    39    41    42   1.50000 -1.0 2.0
   40    39    41    44  -0.86000  1.0 1.0
   40    39    41    44   0.84650 -1.0 2.0
   40    43   -46    33   0.00000  1.0 1.0
   40    43    47    48   1.50000 -1.0 2.0
   40    43    47    57  -0.86000  1.0 1.0
   40    43    47    57   0.84650 -1.0 2.0
   43    47    57    58   0.00000  1.0 1.0
   43    47    57    59   0.38950  1.0 1.0
   43    47    57    59  -0.47050 -1.0 2.0
   43    47    57    59   0.83150  1.0 3.0
   43    47    57    63   0.38950  1.0 1.0
   43    47    57    63  -0.47050 -1.0 2.0
   43    47    57    63   0.83150  1.0 3.0
   46    33   -38    39  -0.12500  1.0 1.0
   46    33   -38    39  -0.12500 -1.0 2.0
   46    33   -38    39   0.25000  1.0 3.0
   46    43    47    48   1.00000 -1.0 2.0
   46    43    47    57   1.00000 -1.0 2.0
   47    43    46    33   0.00000  1.0 1.0
   47    57    59    60   0.22950  1.0 3.0
   47    57    59    61   0.22950  1.0 3.0
   47    57    59    62   0.22950  1.0 3.0
   47    57    63    64   0.22950  1.0 3.0
   47    57    63    65   0.22950  1.0 3.0
   47    57    63    66   0.22950  1.0 3.0
   48    47    57    58   0.00000  1.0 1.0
   48    47    57    59   0.00000  1.0 1.0
   48    47    57    63   0.00000  1.0 1.0
   58    57    59    60   0.15000  1.0 3.0
   58    57    59    61   0.15000  1.0 3.0
   58    57    59    62   0.15000  1.0 3.0
   58    57    63    64   0.15000  1.0 3.0
   58    57    63    65   0.15000  1.0 3.0
   58    57    63    66   0.15000  1.0 3.0
   59    57    63    64   0.15000  1.0 3.0
   59    57    63    65   0.15000  1.0 3.0
   59    57    63    66   0.15000  1.0 3.0
   63    57    59    60   0.15000  1.0 3.0
   63    57    59    61   0.15000  1.0 3.0
   63    57    59    62   0.15000  1.0 3.0
   41    39    40    43   0.00050  1.0 1.0
   41    39    40    43   2.00000 -1.0 2.0
   41    44    49    50   0.22950  1.0 3.0
   41    44    49    51   0.22950  1.0 3.0
   41    44    49    52   0.22950  1.0 3.0
   41    44    53    54   0.22950  1.0 3.0
   41    44    53    55   0.22950  1.0 3.0
   41    44    53    56   0.22950  1.0 3.0
   42    41    44    45   0.00000  1.0 1.0
   42    41    44    49   0.00000  1.0 1.0
   42    41    44    53   0.00000  1.0 1.0
   45    44    49    50   0.15000  1.0 3.0
   45    44    49    51   0.15000  1.0 3.0
   45    44    49    52   0.15000  1.0 3.0
   45    44    53    54   0.15000  1.0 3.0
   45    44    53    55   0.15000  1.0 3.0
   45    44    53    56   0.15000  1.0 3.0
   49    44    53    54   0.15000  1.0 3.0
   49    44    53    55   0.15000  1.0 3.0
   49    44    53    56   0.15000  1.0 3.0
   53    44    49    50   0.15000  1.0 3.0
   53    44    49    51   0.15000  1.0 3.0
   53    44    49    52   0.15000  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
   40    41    39    38  10.50000 -1.0 2.0
   46    47    43    40  10.50000 -1.0 2.0
   48    43    47    57   1.00000 -1.0 2.0
   42    39    41    44   1.00000 -1.0 2.0
END
