* LIGAND DATABASE FILE (OPLS2005)
*
001      63    63    114    170     336
    1     0 S   NP   _N1_     1    28.72344    94.01949   -21.59714
    2     1 S   H    _HN1     2     1.02782    91.53709   -84.81809
    3     1 S   H    _H1_     3     1.02959    93.44604    23.63692
    4     1 S   H    _H2_     4     1.02841    26.61894   146.02871
    5     1 S   CT   _CA1     5     1.50107   137.34171   149.18846
    6     5 S   HC   _HA1     6     1.09568   105.27828    57.70761
    7     5 S   CO3  _C1_     7     1.53842   112.30414   -62.65398
    8     7 S   O2Z  _O11     8     1.26367   115.01858   -45.35388
    9     7 S   O2Z  _O12     9     1.26227   114.92499   133.85916
   10     5 S   CT   _CB1    10     1.53097   107.45422   175.72919
   11    10 S   HC   HB11    11     1.09822   109.55379   -49.66880
   12    10 S   HC   HB12    12     1.09826   110.31780    66.93366
   13    10 S   CT   _CG1    13     1.53018   112.61342  -170.72348
   14    13 S   HC   HG11    14     1.09601   110.40016   -60.03614
   15    13 S   HC   HG12    15     1.09630   110.08821    59.20995
   16    13 S   C    _CD1    16     1.51799   112.21872   179.71401
   17    16 S   O    _OE1    17     1.22725   123.23870    -5.45966
   18    16 S   N    _N2_    18     1.38624   111.64262   174.36271
   19    18 S   H    _HN2    19     1.01589   119.05118     2.51933
   20    18 S   CT1  _CA2    20     1.46285   123.36936  -176.21555
   21    20 S   HC   _HA2    21     1.09728   109.36648   -11.98709
   22    20 S   C    _C2_    22     1.53365   108.59970  -127.87805
   23    22 S   O    _O2_    23     1.23015   122.19323  -146.69412
   24    20 S   CT   _CB2    32     1.53469   111.12760   109.86300
   25    24 S   HC   HB21    33     1.09598   109.59359    56.56118
   26    24 S   HC   HB22    34     1.09505   110.75665   175.50368
   27    22 S   N    _N3_    24     1.38492   113.38957    40.72563
   28    27 S   H    _HN3    25     1.01528   118.90553    -0.72874
   29    24 S   S    _SG2    35     1.82677   111.55029   -64.49786
   30    27 S   CT   _CA3    26     1.45459   123.52200   175.11649
   31    30 S   HC   HA31    27     1.09517   109.33023    22.43435
   32    30 S   HC   HA32    28     1.09498   107.09476   139.45305
   33    29 S   CT   _C9_    36     1.83779    99.15954   160.17147
   34    33 S   HC   _H3_    37     1.09580   105.29710   -53.97168
   35    30 S   CO3  _C3_    29     1.52922   113.07039  -101.11012
   36    35 S   O2Z  _O31    30     1.26406   115.38983   -44.59605
   37    35 S   O2Z  _O32    31     1.26353   114.99319   136.33569
   38    33 S   CT   _C6_    38     1.54196   113.53730  -171.15602
   39    38 S   HC   _H16    39     1.09948   107.41354   166.77701
   40    38 S   CT   _C7_    40     1.53601   111.63417   -75.78887
   41    40 S   HC   _H17    41     1.09710   110.31755    71.16138
   42    38 S   N    _N10    56     1.46258   112.39909    50.30578
   43    42 S   H    _H28    57     1.01576   117.91892   -97.06483
   44    40 S   CT   _C5_    42     1.53924   110.36805   -51.27514
   45    44 S   HC   _H15    43     1.09835   108.00159   -67.69014
   46    40 S   OH   _O13    54     1.43177   109.34917  -171.66497
   47    46 S   HO   _H29    55     0.97248   108.09369    57.74931
   48    42 S   C    _C4_    58     1.38345   122.82141    77.77680
   49    48 S   O    _O33    59     1.22778   125.29987     3.26980
   50    44 S   CT   _C8_    44     1.53898   110.63929    51.96377
   51    50 S   HC   _H18    45     1.09693   110.40121    66.04375
   52    44 S   NTH2 _N9_    51     1.46625   109.42339   175.31287
   53    52 S   H    _H26    52     1.01884   109.96388   168.85184
   54    52 S   H    _H27    53     1.02019   109.27865    52.58413
   55    48 S   CT   _C10    60     1.50452   112.48958  -177.30369
   56    55 S   HC   _H20    61     1.09388   110.23608    48.49730
   57    55 S   HC   _H21    62     1.09348   109.68498   168.05750
   58    55 S   HC   _H22    63     1.09329   109.50504   -72.03394
   59    33 S   OS   _O34    46     1.43191   113.18628    61.52713
   60    50 S   CT   _C11    47     1.52763   112.64295  -173.59914
   61    60 S   HC   _H23    48     1.09563   110.88547    57.71731
   62    60 S   HC   _H24    49     1.09355   112.05285   -64.03275
   63    60 S   HC   _H25    50     1.09585   110.24116   175.51891
  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   8   5   4   3
  14   6   2   1   1  15   8  15   7  10   3  13   8   3   1   5
   4   9   6   4   1   1   3   2   1   1   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    59    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    50    59    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    44    50    51    59    60    46    42    43    48  
   38    39    40    50    59    42  
   36    37  
   37  
    0  
   39    40    41    44    45    50    59    52    46    47    42    43    48    49    55  
   40    41    44    59    46    42    43    48  
   41    44    45    50    51    59    60    52    53    54    46    47    42    43    48  
   44    45    50    52    46    47    42  
   43    48    49    55    56    57    58    44    46    59  
   48    49    55  
   45    50    51    59    60    61    62    63    52    53    54    46    47  
   50    51    59    60    52    53    54    46  
   47    50    52  
    0  
   49    55    56    57    58  
   55    56    57    58  
   51    59    60    61    62    63    52    53    54  
   59    60    61    62    63    52  
   53    54    59    60  
   54  
    0  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62    63  
   61    62    63  
   62    63  
   63  
    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  -0.316400   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   0.318900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   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   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   43   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   44   3.5000   0.0660   0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   50   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   53   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   54   0.5000   0.0300   0.360000   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   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   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    59   320.000  1.410
   38    39   340.000  1.090
   38    40   268.000  1.529
   38    42   337.000  1.449
   40    41   340.000  1.090
   40    44   268.000  1.529
   40    46   320.000  1.410
   44    45   340.000  1.090
   44    50   268.000  1.529
   44    52   300.000  1.468
   50    51   340.000  1.090
   50    59   320.000  1.410
   50    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   52    53   495.000  1.019
   52    54   495.000  1.019
   46    47   553.000  0.945
   42    43   434.000  1.010
   42    48   490.000  1.335
   48    49   570.000  1.229
   48    55   317.000  1.522
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   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    35.00000  109.50000
   29    33    38    75.00000  111.63000
   29    33    59    85.00000  114.68000
   33    38    39    37.50000  110.70000
   33    38    40    58.35000  112.70000
   33    38    42    70.00000  110.72300
   33    59    50    60.00000  109.50000
   38    33    34    37.50000  110.70000
   38    40    41    37.50000  110.70000
   38    40    44    58.35000  112.70000
   38    40    46    50.00000  109.50000
   38    42    43    38.00000  118.40000
   38    42    48    50.00000  121.90000
   40    38    39    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    50    58.35000  112.70000
   40    44    52    80.00000  112.76400
   40    46    47    55.00000  108.50000
   44    40    41    37.50000  110.70000
   44    50    51    37.50000  110.70000
   44    50    59    50.00000  109.50000
   44    50    60    58.35000  112.70000
   44    52    53    50.00000  110.30900
   44    52    54    50.00000  110.30900
   50    44    45    37.50000  110.70000
   50    60    61    37.50000  110.70000
   50    60    62    37.50000  110.70000
   50    60    63    37.50000  110.70000
   59    33    34    35.00000  109.50000
   59    33    38    50.00000  109.50000
   59    50    51    35.00000  109.50000
   60    50    51    37.50000  110.70000
   60    50    59    50.00000  109.50000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   52    44    45    50.00000  110.79000
   52    44    50    80.00000  112.76400
   54    52    53    40.00000  106.77200
   46    40    41    35.00000  109.50000
   46    40    44    50.00000  109.50000
   42    38    39    35.00000  109.50000
   42    38    40    70.00000  110.72300
   42    48    49    80.00000  122.90000
   42    48    55    70.00000  116.60000
   48    42    43    35.00000  119.80000
   48    55    56    35.00000  109.50000
   48    55    57    35.00000  109.50000
   48    55    58    35.00000  109.50000
   55    48    49    80.00000  120.40000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    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   0.32350  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    59   0.13850  1.0 1.0
   24    29    33    59  -1.34450 -1.0 2.0
   24    29    33    59   0.57400  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   0.44750  1.0 1.0
   29    33    38    40  -0.17800 -1.0 2.0
   29    33    38    40   0.20200  1.0 3.0
   29    33    38    42   0.56750  1.0 1.0
   29    33    38    42  -0.07550 -1.0 2.0
   29    33    38    42   0.20000  1.0 3.0
   29    33    59    50   0.14700  1.0 1.0
   29    33    59    50  -1.16150 -1.0 2.0
   29    33    59    50   0.48700  1.0 3.0
   33    38    40    41   0.15000  1.0 3.0
   33    38    40    44   0.56750  1.0 1.0
   33    38    40    44  -0.07550 -1.0 2.0
   33    38    40    44   0.20000  1.0 3.0
   33    38    40    46   0.86500  1.0 1.0
   33    38    40    46  -0.17500 -1.0 2.0
   33    38    40    46   0.20800  1.0 3.0
   33    38    42    43   0.00000  1.0 1.0
   33    38    42    48  -0.43950  1.0 1.0
   33    38    42    48  -0.08100 -1.0 2.0
   33    38    42    48   0.03350  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    59    50   0.37050  1.0 3.0
   38    33    59    50   0.06250  1.0 1.0
   38    33    59    50  -0.01100 -1.0 2.0
   38    33    59    50   0.28050  1.0 3.0
   38    40    44    45   0.15000  1.0 3.0
   38    40   -44    50   0.56750  1.0 1.0
   38    40   -44    50  -0.07550 -1.0 2.0
   38    40   -44    50   0.20000  1.0 3.0
   38    40    44    52   1.85550  1.0 1.0
   38    40    44    52  -0.84100 -1.0 2.0
   38    40    46    47  -0.11600  1.0 1.0
   38    40    46    47  -0.09450 -1.0 2.0
   38    40    46    47   0.21250  1.0 3.0
   38    42    48    49   3.04450 -1.0 2.0
   38    42    48    55   1.49850  1.0 1.0
   38    42    48    55   1.53950 -1.0 2.0
   39    38    40    41   0.15000  1.0 3.0
   39    38    40    44   0.15000  1.0 3.0
   39    38    40    46   0.23400  1.0 3.0
   39    38    42    43   0.00000  1.0 1.0
   39    38    42    48   0.00000  1.0 1.0
   40    38    42    43   0.00000  1.0 1.0
   40    38    42    48  -0.43950  1.0 1.0
   40    38    42    48  -0.08100 -1.0 2.0
   40    38    42    48   0.03350  1.0 3.0
   40    44    50    51   0.15000  1.0 3.0
   40    44    50    59   0.62750  1.0 1.0
   40    44    50    59  -0.30950 -1.0 2.0
   40    44    50    59   0.27300  1.0 3.0
   40    44    50    60   0.56750  1.0 1.0
   40    44    50    60  -0.07550 -1.0 2.0
   40    44    50    60   0.20000  1.0 3.0
   40    44    52    53   0.21650  1.0 1.0
   40    44    52    53   0.26250 -1.0 2.0
   40    44    52    53   0.12450  1.0 3.0
   40    44    52    54   0.21650  1.0 1.0
   40    44    52    54   0.26250 -1.0 2.0
   40    44    52    54   0.12450  1.0 3.0
   41    40    44    45   0.15000  1.0 3.0
   41    40    44    50   0.15000  1.0 3.0
   41    40    44    52   0.15000  1.0 3.0
   41    40    46    47   0.19450  1.0 3.0
   44    40    46    47  -0.11600  1.0 1.0
   44    40    46    47  -0.09450 -1.0 2.0
   44    40    46    47   0.21250  1.0 3.0
   44    50   -59    33   0.06250  1.0 1.0
   44    50   -59    33  -0.01100 -1.0 2.0
   44    50   -59    33   0.28050  1.0 3.0
   44    50    60    61   0.15000  1.0 3.0
   44    50    60    62   0.15000  1.0 3.0
   44    50    60    63   0.15000  1.0 3.0
   45    44    50    51   0.15000  1.0 3.0
   45    44    50    59   0.23400  1.0 3.0
   45    44    50    60   0.15000  1.0 3.0
   45    44    52    53   0.20000  1.0 3.0
   45    44    52    54   0.20000  1.0 3.0
   50    44    52    53   0.21650  1.0 1.0
   50    44    52    53   0.26250 -1.0 2.0
   50    44    52    53   0.12450  1.0 3.0
   50    44    52    54   0.21650  1.0 1.0
   50    44    52    54   0.26250 -1.0 2.0
   50    44    52    54   0.12450  1.0 3.0
   51    50    59    33   0.37050  1.0 3.0
   51    50    60    61   0.15000  1.0 3.0
   51    50    60    62   0.15000  1.0 3.0
   51    50    60    63   0.15000  1.0 3.0
   59    33    38    39   0.23400  1.0 3.0
   59    33   -38    40   0.62750  1.0 1.0
   59    33   -38    40  -0.30950 -1.0 2.0
   59    33   -38    40   0.27300  1.0 3.0
   59    33    38    42   1.12100  1.0 1.0
   59    33    38    42  -0.16500 -1.0 2.0
   59    50    60    61   0.23400  1.0 3.0
   59    50    60    62   0.23400  1.0 3.0
   59    50    60    63   0.23400  1.0 3.0
   60    50    59    33   0.06250  1.0 1.0
   60    50    59    33  -0.01100 -1.0 2.0
   60    50    59    33   0.28050  1.0 3.0
   52    44    50    51   0.15000  1.0 3.0
   52    44    50    59   3.18800  1.0 1.0
   52    44    50    59  -1.12350 -1.0 2.0
   52    44    50    60   1.53400  1.0 1.0
   52    44    50    60  -0.09950 -1.0 2.0
   52    44    50    60   0.05700  1.0 3.0
   46    40    44    45   0.23400  1.0 3.0
   46    40    44    50   0.86500  1.0 1.0
   46    40    44    50  -0.17500 -1.0 2.0
   46    40    44    50   0.20800  1.0 3.0
   46    40    44    52   5.28650  1.0 1.0
   42    38    40    41   0.15000  1.0 3.0
   42    38    40    44  -0.27100  1.0 1.0
   42    38    40    44  -0.01700 -1.0 2.0
   42    38    40    44  -0.48600  1.0 3.0
   42    38    40    46   2.76900  1.0 1.0
   42    38    40    46  -0.24350 -1.0 2.0
   42    38    40    46  -0.78250  1.0 3.0
   42    48    55    56   0.00000  1.0 1.0
   42    48    55    57   0.00000  1.0 1.0
   42    48    55    58   0.00000  1.0 1.0
   43    42    48    49   2.45000 -1.0 2.0
   43    42    48    55   2.45000 -1.0 2.0
   49    48    55    56   0.00000  1.0 1.0
   49    48    55    57   0.00000  1.0 1.0
   49    48    55    58   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
   37    30    35    36  10.50000 -1.0 2.0
   43    48    42    38   1.00000 -1.0 2.0
   42    55    48    49  10.50000 -1.0 2.0
END
