* LIGAND DATABASE FILE (OPLS2005)
*
001      66    68    114    186     337
    1     0 S   NP   _N1_     1    32.83193   101.75199   -20.05796
    2     1 S   H    _HN1     2     1.02744    47.23670  -120.32155
    3     1 S   H    _H1_     3     1.02882   100.94878   135.69363
    4     1 S   H    _H2_     4     1.03502   147.69705   -73.17895
    5     1 S   CT   _CA1     5     1.50408    71.15191    27.91879
    6     5 S   HC   _HA1     6     1.09528   104.17247   158.48197
    7     5 S   CO3  _C1_     7     1.54385   111.68544    42.61193
    8     7 S   O2Z  _O11     8     1.26047   116.63382  -130.89528
    9     7 S   O2Z  _O12     9     1.26642   114.03749    48.74337
   10     5 S   CT   _CB1    10     1.53145   107.05686   -85.82953
   11    10 S   HC   HB11    11     1.09672   109.54312   -40.37400
   12    10 S   HC   HB12    12     1.09793   109.95859    75.23355
   13    10 S   CT   _CG1    13     1.53367   112.84698  -163.12080
   14    13 S   HC   HG11    14     1.09563   110.74868  -102.31586
   15    13 S   HC   HG12    15     1.09471   111.79078    16.89481
   16    13 S   C    _CD1    16     1.51386   110.07474   137.80248
   17    16 S   O    _OE1    17     1.22817   121.90430    93.33570
   18    16 S   N    _N2_    18     1.38533   112.67901   -83.90190
   19    18 S   H    _HN2    19     1.01628   119.26455    -3.61855
   20    18 S   CT1  _CA2    20     1.45989   122.54578   172.83850
   21    20 S   HC   _HA2    21     1.09711   108.66791    30.08029
   22    20 S   C    _C2_    22     1.53259   109.25566   -86.32765
   23    22 S   O    _O2_    23     1.23134   121.00537   154.36268
   24    20 S   CT   _CB2    32     1.53070   111.99237   153.34794
   25    24 S   HC   HB21    33     1.09433   110.25595    56.90315
   26    24 S   HC   HB22    34     1.09569   110.18346   174.48957
   27    22 S   N    _N3_    24     1.38271   114.58729   -32.99306
   28    27 S   H    _HN3    25     1.01530   119.50646     2.82646
   29    24 S   S    _SG2    35     1.82839   111.42187   -66.63865
   30    27 S   CT   _CA3    26     1.45301   123.18162  -177.23770
   31    30 S   HC   HA31    27     1.09559   108.25981   -44.68971
   32    30 S   HC   HA32    28     1.09542   107.24268    71.75194
   33    29 S   CT   _C10    36     1.84149    99.98166   133.07759
   34    33 S   HC   _H3_    37     1.09698   104.61287    45.22014
   35    30 S   CO3  _C3_    29     1.52962   114.30298  -166.93950
   36    35 S   O2Z  _O31    30     1.26429   116.25661    -0.00000
   37    35 S   O2Z  _O32    31     1.26409   114.47363   179.69481
   38    33 S   CA   _C9_    38     1.52280   111.86594   160.81018
   39    33 S   C5A  _C11    51     1.49682   111.46640   -72.11639
   40    38 S   CA   _C4_    39     1.40618   119.31930  -125.10730
   41    40 S   HA   _H4_    40     1.08793   120.30291     0.58551
   42    39 S   C5B  _C12    52     1.37810   134.19587   118.03128
   43    42 S   OM   _O36    53     1.33204   125.92233    -0.05935
   44    40 S   CA   _C5_    41     1.39711   121.00602  -179.24723
   45    44 S   HA   _H5_    42     1.08617   119.32071  -179.88636
   46    42 S   C56B _C13    54     1.41556   108.36003  -179.90109
   47    44 S   CA   _C6_    43     1.39233   119.71171     0.27766
   48    46 S   C56A _C18    55     1.39240   104.81934    -0.22029
   49    47 S   CA   _C7_    44     1.39146   120.10465     0.13122
   50    47 S   OH   _O38    49     1.36707   120.49027   179.97202
   51    50 S   HO   _H12    50     0.97200   108.67984    -0.08393
   52    48 S   CA   _C17    56     1.39431   124.17573  -179.96574
   53    52 S   HA   _H8_    57     1.08333   121.69449  -179.54158
   54    39 S   OA   _O33    66     1.37169   117.09140   -61.77737
   55    38 S   CA   _C8_    45     1.40625   122.26276    56.34452
   56    55 S   HA   _H6_    46     1.08722   119.99633    -0.66441
   57    49 S   OH   _O37    47     1.36774   119.29285   179.73093
   58    57 S   HO   _H11    48     0.97209   108.66610  -179.45035
   59    52 S   CA   _C16    58     1.39712   116.14152    -0.70499
   60    59 S   CA   _C15    59     1.39559   122.17988     0.90157
   61    60 S   HA   _H7_    60     1.08663   120.57745  -179.96044
   62    59 S   OH   _O34    64     1.36955   117.39446  -178.39978
   63    62 S   HO   _H9_    65     0.97323   108.39272   168.97498
   64    46 S   CA   _C14    61     1.40902   137.38488   179.65282
   65    64 S   OH   _O35    62     1.37565   121.97042    -0.13562
   66    65 S   HO   _H10    63     0.97574   106.73700     0.33220
  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  12   9   8   4   8   4   7   3  10   7   8
   6   3   1   8   4   2   3   1   1   1   6   6   3   2   1   2
   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    40    55    39    42    54  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    44    49    55    56    39    42    43    46    48    54  
   38    40    55    39    42    54  
   36    37  
   37  
    0  
   40    41    44    45    47    49    55    56    57    39    42    54  
   42    43    46    48    52    64    54    40    55  
   41    44    45    47    49    55    56    50  
   44    45    47    55  
   43    46    48    52    60    64    65    54  
   46    48    64    54  
   45    47    49    55    57    50    51  
   47    49    50  
   48    52    53    59    60    61    64    65    66    54  
   49    55    56    57    58    50    51  
   52    53    59    60    64    65    62    54  
   55    56    57    58    50    51  
   51    55    57  
    0  
   53    59    60    61    64    62    63    54  
   59    60    62    54  
   59    64  
   56    57    58  
   57  
   58  
    0  
   60    61    64    65    62    63  
   61    64    65    66    62    63  
   64    65    62  
   63    64  
    0  
   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  -0.335000   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   0.337500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0700   0.136300   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5500   0.0700  -0.442700   2.5000   1.7750   0.001000000  -0.843144165
   43   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   44   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   45   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   46   3.5500   0.0700   0.258100   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700   0.323000   2.5000   1.7750   0.001000000  -0.843144165
   49   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   50   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   51   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   52   3.5500   0.0700  -0.324500   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.195500   1.3810   1.2100   0.030040813   0.268726247
   54   3.0000   0.1700  -0.311500   1.7000   1.5000   0.001000000  -0.126889456
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5500   0.0700   0.177000   2.0020   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0700  -0.192500   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.157100   1.3810   1.2100   0.030040813   0.268726247
   62   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.5500   0.0700   0.039200   2.0020   1.7750   0.001000000  -0.843144165
   65   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   66   0.5000   0.0300   0.435000   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    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   317.000  1.510
   33    39   295.000  1.489
   38    40   469.000  1.400
   38    55   469.000  1.400
   40    41   367.000  1.080
   40    44   469.000  1.400
   44    45   367.000  1.080
   44    47   469.000  1.400
   47    49   469.000  1.400
   47    50   450.000  1.364
   49    55   469.000  1.400
   49    57   450.000  1.364
   55    56   367.000  1.080
   57    58   553.000  0.945
   50    51   553.000  0.945
   39    42   520.000  1.370
   39    54   340.000  1.360
   42    43   480.000  1.345
   42    46   380.000  1.440
   46    48   447.000  1.419
   46    64   469.000  1.404
   48    52   469.000  1.400
   48    54   425.000  1.380
   52    53   367.000  1.080
   52    59   469.000  1.400
   59    60   469.000  1.400
   59    62   450.000  1.364
   60    61   367.000  1.080
   60    64   469.000  1.400
   64    65   450.000  1.364
   65    66   553.000  0.945
   62    63   553.000  0.945
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    80.00000  109.48900
   29    33    39    80.00000  109.48900
   33    38    40    70.00000  120.00000
   33    38    55    70.00000  120.00000
   33    39    42    55.00000  130.44200
   33    39    54    80.00000  116.10000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  120.00000
   38    40    44    63.00000  120.00000
   38    55    49    63.00000  120.00000
   38    55    56    35.00000  120.00000
   40    44    45    35.00000  120.00000
   40    44    47    63.00000  120.00000
   44    40    41    35.00000  120.00000
   44    47    49    63.00000  120.00000
   44    47    50    70.00000  120.00000
   47    44    45    35.00000  120.00000
   47    49    55    63.00000  120.00000
   47    49    57    70.00000  120.00000
   47    50    51    35.00000  113.00000
   49    55    56    35.00000  120.00000
   49    57    58    35.00000  113.00000
   55    38    40    63.00000  120.00000
   57    49    55    70.00000  120.00000
   50    47    49    70.00000  120.00000
   39    33    34    45.00000  110.47400
   39    33    38    70.00000  112.04700
   39    42    43    75.00000  125.18600
   39    42    46    80.00000  105.82900
   39    54    48   110.00000  105.28000
   42    46    48    80.00000  107.43600
   42    46    64    50.00000  134.85500
   46    42    43    70.00000  112.00000
   46    48    52    85.00000  122.70000
   46    48    54   100.00000  108.43400
   46    64    60    63.00000  120.00000
   46    64    65    70.00000  120.00000
   48    52    53    35.00000  120.00000
   48    52    59    85.00000  120.00000
   52    59    60    63.00000  120.00000
   52    59    62    70.00000  120.00000
   59    52    53    35.00000  120.00000
   59    60    61    35.00000  120.00000
   59    60    64    63.00000  120.00000
   59    62    63    35.00000  113.00000
   60    64    65    70.00000  120.00000
   64    46    48    85.00000  116.20000
   64    60    61    35.00000  120.00000
   64    65    66    35.00000  113.00000
   62    59    60    70.00000  120.00000
   54    39    42    70.00000  108.00000
   54    48    52    70.00000  124.10000
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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39  -0.23050  1.0 1.0
   24    29    33    39   0.06200 -1.0 2.0
   24    29    33    39   0.47200  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    40  -0.16000  1.0 1.0
   29    33    38    40  -0.03200 -1.0 2.0
   29    33    38    40   0.04500  1.0 3.0
   29    33    38    55  -0.16000  1.0 1.0
   29    33    38    55  -0.03200 -1.0 2.0
   29    33    38    55   0.04500  1.0 3.0
   29    33    39    42  -0.16000  1.0 1.0
   29    33    39    42  -0.03200 -1.0 2.0
   29    33    39    42   0.04500  1.0 3.0
   29    33    39    54   0.04300 -1.0 2.0
   33    38    40    41   3.62500 -1.0 2.0
   33    38    40    44   3.62500 -1.0 2.0
   33    38    55    49   3.62500 -1.0 2.0
   33    38    55    56   3.62500 -1.0 2.0
   33    39    42    43   3.62500 -1.0 2.0
   33    39    42    46   3.62500 -1.0 2.0
   33    39    54    48   3.62500 -1.0 2.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    38    55   0.00000  1.0 1.0
   34    33    39    42   0.00000  1.0 1.0
   34    33    39    54   0.00000  1.0 1.0
   38    33    39    42   0.04300 -1.0 2.0
   38    33    39    54   0.04300 -1.0 2.0
   38    40    44    45   3.62500 -1.0 2.0
   38    40    44    47   3.62500 -1.0 2.0
   40    38    55    49   3.62500 -1.0 2.0
   40    38    55    56   3.62500 -1.0 2.0
   40    44   -47    49   3.62500 -1.0 2.0
   40    44    47    50   3.62500 -1.0 2.0
   41    40    44    45   3.62500 -1.0 2.0
   41    40    44    47   3.62500 -1.0 2.0
   44    47    49    55   3.62500 -1.0 2.0
   44    47    49    57   3.62500 -1.0 2.0
   44    47    50    51   0.84100 -1.0 2.0
   45    44    47    49   3.62500 -1.0 2.0
   45    44    47    50   3.62500 -1.0 2.0
   47    49   -55    38   3.62500 -1.0 2.0
   47    49    55    56   3.62500 -1.0 2.0
   47    49    57    58   0.84100 -1.0 2.0
   49    47    50    51   0.84100 -1.0 2.0
   55    38    40    41   3.62500 -1.0 2.0
   55    38   -40    44   3.62500 -1.0 2.0
   55    49    57    58   0.84100 -1.0 2.0
   57    49    55    38   3.62500 -1.0 2.0
   57    49    55    56   3.62500 -1.0 2.0
   50    47    49    55   3.62500 -1.0 2.0
   50    47    49    57   3.62500 -1.0 2.0
   39    33    38    40   0.04300 -1.0 2.0
   39    33    38    55   0.04300 -1.0 2.0
   39    42   -46    48   3.50000 -1.0 2.0
   39    42    46    64   3.62500 -1.0 2.0
   42    39   -54    48   3.62500 -1.0 2.0
   42    46    48    52   3.00000 -1.0 2.0
   42    46   -48    54   3.62500 -1.0 2.0
   42    46    64    60   3.62500 -1.0 2.0
   42    46    64    65   3.62500 -1.0 2.0
   43    42    46    48   3.62500 -1.0 2.0
   43    42    46    64   3.62500 -1.0 2.0
   46    48    52    53   3.62500 -1.0 2.0
   46    48    52    59   3.62500 -1.0 2.0
   46    48   -54    39   3.62500 -1.0 2.0
   46    64    65    66   0.84100 -1.0 2.0
   48    46    64    60   3.50000 -1.0 2.0
   48    46    64    65   3.62500 -1.0 2.0
   48    52   -59    60   3.62500 -1.0 2.0
   48    52    59    62   3.62500 -1.0 2.0
   52    48    54    39   3.62500 -1.0 2.0
   52    59    60    61   3.62500 -1.0 2.0
   52    59    60    64   3.62500 -1.0 2.0
   52    59    62    63   0.84100 -1.0 2.0
   53    52    59    60   3.62500 -1.0 2.0
   53    52    59    62   3.62500 -1.0 2.0
   59    60   -64    46   3.62500 -1.0 2.0
   59    60    64    65   3.62500 -1.0 2.0
   60    59    62    63   0.84100 -1.0 2.0
   60    64    65    66   0.84100 -1.0 2.0
   61    60    64    46   3.62500 -1.0 2.0
   61    60    64    65   3.62500 -1.0 2.0
   64    46   -48    52   3.00000 -1.0 2.0
   64    46    48    54   3.62500 -1.0 2.0
   62    59    60    61   3.62500 -1.0 2.0
   62    59    60    64   3.62500 -1.0 2.0
   54    39    42    43   3.62500 -1.0 2.0
   54    39   -42    46   3.62500 -1.0 2.0
   54    48    52    53   3.62500 -1.0 2.0
   54    48    52    59   3.62500 -1.0 2.0
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    55    38    33   4.00000 -1.0 2.0
   44    41    40    38   1.10000 -1.0 2.0
   47    45    44    40   1.10000 -1.0 2.0
   49    50    47    44   4.00000 -1.0 2.0
   55    57    49    47   4.00000 -1.0 2.0
   49    56    55    38   1.10000 -1.0 2.0
   42    54    39    33   4.00000 -1.0 2.0
   46    43    42    39   4.00000 -1.0 2.0
   48    64    46    42   4.00000 -1.0 2.0
   52    54    48    46   4.00000 -1.0 2.0
   59    53    52    48   1.10000 -1.0 2.0
   60    62    59    52   4.00000 -1.0 2.0
   64    61    60    59   1.10000 -1.0 2.0
   60    65    64    46   4.00000 -1.0 2.0
END
