* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    113    166     329
    1     0 S   NP   _N1_     1    29.78633    95.86654   -17.80610
    2     1 S   H    _HN1     2     1.02774    65.21010   -77.03549
    3     1 S   H    _H1_     3     1.02962    94.07557    31.31518
    4     1 S   H    _H2_     4     1.02828    51.54769   139.89515
    5     1 S   CT   _CA1     5     1.50125   154.18197  -167.21792
    6     5 S   HC   _HA1     6     1.09557   105.28424    17.39859
    7     5 S   CO3  _C1_     7     1.53894   112.33215  -103.03082
    8     7 S   O2Z  _O11     8     1.26371   114.97920   -41.72270
    9     7 S   O2Z  _O12     9     1.26231   115.01950   137.44684
   10     5 S   CT   _CB1    10     1.53092   107.42150   135.60475
   11    10 S   HC   HB11    11     1.09818   109.69162   -47.57671
   12    10 S   HC   HB12    12     1.09831   110.26680    69.10257
   13    10 S   CT   _CG1    13     1.52976   112.57587  -168.58028
   14    13 S   HC   HG11    14     1.09529   110.43584   -57.62408
   15    13 S   HC   HG12    15     1.09630   110.12141    61.45138
   16    13 S   C    _CD1    16     1.51801   112.12475  -178.29188
   17    16 S   O    _OE1    17     1.22727   123.23386   -11.60650
   18    16 S   N    _N2_    18     1.38573   111.65660   168.82218
   19    18 S   H    _HN2    19     1.01597   118.97640     2.10970
   20    18 S   CT1  _CA2    20     1.46251   123.48323  -178.10411
   21    20 S   HC   _HA2    21     1.09728   109.42775   -11.90777
   22    20 S   C    _C2_    22     1.53358   108.37444  -127.58395
   23    22 S   O    _O2_    23     1.23024   122.40655  -147.82096
   24    20 S   CT   _CB2    32     1.53491   111.07651   110.23315
   25    24 S   HC   HB21    33     1.09284   109.21239    55.34604
   26    24 S   HC   HB22    34     1.09510   110.59278   173.47688
   27    22 S   N    _N3_    24     1.38377   113.43703    39.69548
   28    27 S   H    _HN3    25     1.01654   119.49027    -3.61606
   29    24 S   S    _SG2    35     1.83037   111.17752   -67.73255
   30    27 S   CT   _CA3    26     1.45294   123.08853   176.91365
   31    30 S   HC   HA31    27     1.09553   107.52509   -63.71731
   32    30 S   HC   HA32    28     1.09559   107.93774    52.67696
   33    29 S   CT   _C9_    36     1.86361   102.63603   146.03779
   34    30 S   CO3  _C3_    29     1.52925   114.16660   174.66314
   35    34 S   O2Z  _O31    30     1.26361   116.05774    -0.78584
   36    34 S   O2Z  _O32    31     1.26430   114.41243   179.27882
   37    33 S   CT   _C8_    37     1.54762   111.90531   -66.22436
   38    37 S   HC   _H9_    38     1.09944   108.93754   175.50987
   39    37 S   HC   _H10    39     1.09531   111.43446    59.95298
   40    33 S   CT   _C12    59     1.53888   109.13453    55.71658
   41    40 S   HC   _H12    60     1.09617   111.49886    57.49890
   42    40 S   HC   _H13    61     1.09468   112.34672   -64.07433
   43    40 S   HC   _H14    62     1.09615   111.19704   177.04686
   44    37 S   CT   _C7_    40     1.53527   114.03885   -63.75206
   45    44 S   HC   _H7_    41     1.09375   106.96905  -176.20982
   46    44 S   HC   _H8_    42     1.09511   110.39854    68.53215
   47    44 S   CM   _C6_    43     1.50661   112.21247   -52.99768
   48    47 S   CO4  _C11    44     1.50017   113.04484    47.56244
   49    48 S   O    _O33    45     1.22892   121.74654   132.11602
   50    47 S   CM   _C5_    50     1.35171   126.73618  -132.32719
   51    33 S   CT   _C10    46     1.55037   106.73728   174.39129
   52    51 S   HC   _H3_    47     1.09695   111.03860   -52.54530
   53    50 S   CT   _C4_    51     1.50926   123.32940    -4.80453
   54    53 S   HC   _H4_    52     1.09471   110.12980   106.29222
   55    53 S   HC   _H5_    53     1.09593   110.00889  -134.46089
   56    53 S   HC   _H6_    54     1.09199   113.68629   -15.56492
   57    50 S   CT   _C13    55     1.51022   124.35993   174.72185
   58    57 S   HC   _H15    56     1.09462   110.16030   104.34423
   59    57 S   HC   _H16    57     1.09600   110.07074  -136.36507
   60    57 S   HC   _H17    58     1.09298   113.50038   -17.77926
   61    51 S   OH   _O34    48     1.42600   110.85113  -171.82665
   62    61 S   HO   _H11    49     0.97316   107.45427   172.68337
  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  15   7   6   8   3   2   1   9   4   3  14   8
   4   9   3   2   7   3   2   1   3   2   1   1   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    51    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    44    48    51    52    61    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    45    46    47    48    49    51    52    61    62    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    45    46    47    48    51    52    61    50    40    41    42    43  
   39    44    45    46    47    51    40  
   44    45    46    47    51    40  
   41    42    43    44    48    51    52    61  
   42    43    51  
   43    51  
   51  
   45    46    47    48    49    51    50    53    57  
   46    47    48    50  
   47    48    50  
   48    49    51    52    61    50    53    54    55    56    57    58    59    60  
   49    51    52    61    62    50    53    57  
   51    52    61    50  
   53    54    55    56    57    58    59    60    51  
   52    61    62  
   61    62  
   54    55    56    57    58    59    60  
   55    56    57  
   56    57  
   57  
   58    59    60  
   59    60  
   60  
    0  
   62  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   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  -0.120000   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   48   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   50   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.060000   1.3810   1.2100   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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    51   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    47   317.000  1.510
   47    48   320.000  1.462
   47    50   549.000  1.340
   48    49   570.000  1.229
   48    51   317.000  1.522
   51    52   340.000  1.090
   51    61   320.000  1.410
   61    62   553.000  0.945
   50    53   317.000  1.510
   50    57   317.000  1.510
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   340.000  1.090
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   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    51    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    44    58.35000  112.70000
   33    51    48    63.00000  111.10000
   33    51    52    37.50000  110.70000
   33    51    61    50.00000  109.50000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    37.50000  110.70000
   37    44    46    37.50000  110.70000
   37    44    47    70.00000  112.02700
   39    37    38    33.00000  107.80000
   44    37    38    37.50000  110.70000
   44    37    39    37.50000  110.70000
   44    47    48    65.00000  116.34900
   44    47    50    70.00000  124.00000
   46    44    45    33.00000  107.80000
   47    44    45    35.00000  109.50000
   47    44    46    35.00000  109.50000
   47    48    49    80.00000  123.72100
   47    48    51    65.00000  118.62400
   47    50    53    70.00000  124.00000
   47    50    57    70.00000  124.00000
   48    51    52    35.00000  109.50000
   48    51    61    90.00000  109.61100
   51    33    37    58.35000  112.70000
   51    48    49    80.00000  120.40000
   51    61    62    55.00000  108.50000
   61    51    52    35.00000  109.50000
   50    47    48    65.00000  118.96000
   50    53    54    35.00000  109.50000
   50    53    55    35.00000  109.50000
   50    53    56    35.00000  109.50000
   50    57    58    35.00000  109.50000
   50    57    59    35.00000  109.50000
   50    57    60    35.00000  109.50000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   57    50    53    65.00000  117.92700
   59    57    58    33.00000  107.80000
   60    57    58    33.00000  107.80000
   60    57    59    33.00000  107.80000
   40    33    37    58.35000  112.70000
   40    33    51    58.35000  112.70000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    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    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   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    44   0.44750  1.0 1.0
   29    33    37    44  -0.17800 -1.0 2.0
   29    33    37    44   0.20200  1.0 3.0
   29    33    51    48   0.56750  1.0 1.0
   29    33    51    48  -0.07550 -1.0 2.0
   29    33    51    48   0.20000  1.0 3.0
   29    33    51    52   0.15000  1.0 3.0
   29    33    51    61   0.56750  1.0 1.0
   29    33    51    61  -0.07550 -1.0 2.0
   29    33    51    61   0.20000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    43   0.15000  1.0 3.0
   33    37    44    45   0.15000  1.0 3.0
   33    37    44    46   0.15000  1.0 3.0
   33    37    44    47   0.34400  1.0 1.0
   33    37    44    47   0.09450 -1.0 2.0
   33    37    44    47   0.11100  1.0 3.0
   33    51    61    62  -0.11600  1.0 1.0
   33    51    61    62  -0.09450 -1.0 2.0
   33    51    61    62   0.21250  1.0 3.0
   37    33    51    48  -0.95700  1.0 1.0
   37    33    51    48  -0.18200 -1.0 2.0
   37    33    51    48   0.29450  1.0 3.0
   37    33    51    52   0.15000  1.0 3.0
   37    33    51    61   0.86500  1.0 1.0
   37    33    51    61  -0.17500 -1.0 2.0
   37    33    51    61   0.20800  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    43   0.15000  1.0 3.0
   37    44   -47    48   0.09700  1.0 1.0
   37    44   -47    48   0.15600 -1.0 2.0
   37    44   -47    48  -0.50800  1.0 3.0
   37    44    47    50   0.09850  1.0 1.0
   37    44    47    50   0.15250 -1.0 2.0
   37    44    47    50  -0.50650  1.0 3.0
   38    37    44    45   0.15000  1.0 3.0
   38    37    44    46   0.15000  1.0 3.0
   38    37    44    47   0.15000  1.0 3.0
   39    37    44    45   0.15000  1.0 3.0
   39    37    44    46   0.15000  1.0 3.0
   39    37    44    47   0.15000  1.0 3.0
   44    47    48    49  -0.64400  1.0 1.0
   44    47    48    49   0.26850 -1.0 2.0
   44    47    48    51   0.25700  1.0 1.0
   44    47    48    51   0.66200 -1.0 2.0
   44    47    48    51   0.04450  1.0 3.0
   44    47    50    53   7.00000 -1.0 2.0
   44    47    50    57   7.00000 -1.0 2.0
   45    44    47    48   0.15000  1.0 3.0
   45    44    47    50   0.00000  1.0 1.0
   46    44    47    48   0.15000  1.0 3.0
   46    44    47    50   0.00000  1.0 1.0
   47    48   -51    33   0.65300  1.0 1.0
   47    48   -51    33  -0.03850 -1.0 2.0
   47    48   -51    33   0.33900  1.0 3.0
   47    48    51    52   0.00000  1.0 1.0
   47    48    51    61   0.65300  1.0 1.0
   47    48    51    61  -0.03850 -1.0 2.0
   47    48    51    61   0.33900  1.0 3.0
   47    50    53    54   0.00000  1.0 1.0
   47    50    53    55   0.00000  1.0 1.0
   47    50    53    56   0.00000  1.0 1.0
   47    50    57    58   0.00000  1.0 1.0
   47    50    57    59   0.00000  1.0 1.0
   47    50    57    60   0.00000  1.0 1.0
   48    47    50    53   7.00000 -1.0 2.0
   48    47    50    57   7.00000 -1.0 2.0
   48    51    61    62   0.91850  1.0 1.0
   48    51    61    62   0.57950  1.0 3.0
   49    48    51    33   0.30150 -1.0 2.0
   49    48    51    52   0.00000  1.0 1.0
   49    48    51    61   0.30150 -1.0 2.0
   51    33    37    38   0.15000  1.0 3.0
   51    33    37    39   0.15000  1.0 3.0
   51    33   -37    44   0.56750  1.0 1.0
   51    33   -37    44  -0.07550 -1.0 2.0
   51    33   -37    44   0.20000  1.0 3.0
   51    33    40    41   0.15000  1.0 3.0
   51    33    40    42   0.15000  1.0 3.0
   51    33    40    43   0.15000  1.0 3.0
   52    51    61    62   0.19450  1.0 3.0
   50    47    48    49   1.00000 -1.0 2.0
   50    47    48    51  -0.33500  1.0 1.0
   50    47    48    51   1.06600 -1.0 2.0
   50    47    48    51  -0.14000  1.0 3.0
   53    50    57    58   0.34800  1.0 3.0
   53    50    57    59   0.34800  1.0 3.0
   53    50    57    60   0.34800  1.0 3.0
   57    50    53    54   0.34800  1.0 3.0
   57    50    53    55   0.34800  1.0 3.0
   57    50    53    56   0.34800  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    44   0.56750  1.0 1.0
   40    33    37    44  -0.07550 -1.0 2.0
   40    33    37    44   0.20000  1.0 3.0
   40    33    51    48  -0.95700  1.0 1.0
   40    33    51    48  -0.18200 -1.0 2.0
   40    33    51    48   0.29450  1.0 3.0
   40    33    51    52   0.15000  1.0 3.0
   40    33    51    61   0.86500  1.0 1.0
   40    33    51    61  -0.17500 -1.0 2.0
   40    33    51    61   0.20800  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
   35    30    34    36  10.50000 -1.0 2.0
   44    48    47    50   1.10000 -1.0 2.0
   47    51    48    49  10.50000 -1.0 2.0
   53    57    50    47   1.10000 -1.0 2.0
END
