* LIGAND DATABASE FILE (OPLS2005)
*
001      57    56     98    132     280
    1     0 S   NP   _N1_     1    29.04882    95.64375   -21.15779
    2     1 S   H    _HN1     2     1.02957    81.50103    17.52657
    3     1 S   H    _H1_     3     1.02836    39.28620   148.16953
    4     1 S   H    _H2_     4     1.02780    88.85823   -91.20727
    5     1 S   CT   _CA1     5     1.50104   149.40429   133.65693
    6     5 S   HC   _HA1     6     1.09574   105.24947    69.03424
    7     5 S   CO3  _C1_     7     1.53810   112.35549   -51.23468
    8     7 S   O2Z  _O11     8     1.26360   115.00175   -45.11187
    9     7 S   O2Z  _O12     9     1.26231   114.93416   134.04584
   10     5 S   CT   _CB1    10     1.53095   107.43688  -173.02012
   11    10 S   HC   HB11    11     1.09823   109.44970   -50.55267
   12    10 S   HC   HB12    12     1.09817   110.40720    66.06794
   13    10 S   CT   _CG1    13     1.52961   112.54392  -171.60176
   14    13 S   HC   HG11    14     1.09528   110.36421   -62.92893
   15    13 S   HC   HG12    15     1.09656   109.96387    56.22229
   16    13 S   C    _CD1    16     1.51779   112.36760   176.74960
   17    16 S   O    _OE1    17     1.22726   123.30939     0.42978
   18    16 S   N    _N2_    18     1.38572   111.62033  -179.61845
   19    18 S   H    _HN2    19     1.01644   119.01705     1.39536
   20    18 S   CT1  _CA2    20     1.46155   123.47615   179.20598
   21    20 S   HC   _HA2    21     1.09723   109.34032    -6.26206
   22    20 S   C    _C2_    22     1.53494   109.10644  -121.91047
   23    22 S   O    _O2_    23     1.23061   122.11119  -154.27674
   24    20 S   CT   _CB2    32     1.53248   111.20151   115.82916
   25    24 S   HC   HB21    33     1.09408   109.64713    55.52198
   26    24 S   HC   HB22    34     1.09520   110.64563   173.59439
   27    22 S   N    _N3_    24     1.38276   113.79124    33.31944
   28    27 S   H    _HN3    25     1.01610   119.47691    -4.29838
   29    24 S   S    _SG2    35     1.82809   111.71245   -67.54287
   30    27 S   CT   _CA3    26     1.45277   123.15916   177.54545
   31    30 S   HC   HA31    27     1.09554   107.59595   -61.40346
   32    30 S   HC   HA32    28     1.09555   107.89064    55.02261
   33    29 S   S    _S10    36     2.05347   102.92165   136.50458
   34    30 S   CO3  _C3_    29     1.52936   114.03624   176.77056
   35    34 S   O2Z  _O31    30     1.26388   116.02092    -5.56102
   36    34 S   O2Z  _O32    31     1.26433   114.46577   174.41465
   37    33 S   S    _S12    37     2.05119   105.27124   -90.67496
   38    37 S   S    _S11    38     2.04874   106.09756    86.36041
   39    38 S   S    _S9_    39     2.05145   105.84389    89.41021
   40    39 S   CT   _C7_    40     1.83485   104.38926   -87.18378
   41    40 S   HC   _H21    41     1.09393   106.84272    68.27556
   42    40 S   HC   _H22    42     1.09561   105.19921  -178.68136
   43    40 S   CT   _C8_    43     1.55332   116.77480   -56.73652
   44    43 S   HC   _H23    44     1.09763   107.49136    56.56682
   45    43 S   CT   _C6_    45     1.56014   111.70756   -60.42730
   46    45 S   SM   _S8_    46     1.84297   111.52466   165.61749
   47    45 S   HC   _H19    47     1.09517   109.35489    45.07939
   48    45 S   HC   _H20    48     1.09599   110.01680   -69.02090
   49    43 S   NT   _N6_    49     1.49034   112.69541   173.82016
   50    49 S   CT   _C4_    50     1.46056   115.22344    51.38957
   51    50 S   HC   _H13    51     1.09371   111.92845    53.18172
   52    50 S   HC   _H14    52     1.09539   112.58028   -69.33622
   53    50 S   HC   _H15    53     1.09629   110.02199   170.71905
   54    49 S   CT   _C5_    54     1.46153   112.59766   -76.53819
   55    54 S   HC   _H16    55     1.09448   110.81105   -55.60097
   56    54 S   HC   _H17    56     1.09606   110.43383  -172.86961
   57    54 S   HC   _H18    57     1.09455   112.67558    66.35159
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   6   3   2   7   4   3   5   4   3
   3   2   1   1   3   5   7  11   5   4  14   7   6   3   2   1
   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39  
   35    36  
   36  
    0  
   38    39    40  
   39    40    41    42    43  
   40    41    42    43    44    45    49  
   41    42    43    44    45    46    47    48    49    50    54  
   42    43    44    45    49  
   43    44    45    49  
   44    45    46    47    48    49    50    51    52    53    54    55    56    57  
   45    46    47    48    49    50    54  
   46    47    48    49    50    54  
   47    48    49  
   48    49  
   49  
   50    51    52    53    54    55    56    57  
   51    52    53    54    55    56    57  
   52    53    54  
   53    54  
   54  
   55    56    57  
   56    57  
   57  
    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  -0.112500   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  -0.007500   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   3.6000   0.3550   0.000000   2.0300   1.8000   0.025682759  -1.666211680
   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   3.6000   0.3550   0.000000   2.0300   1.8000   0.025682759  -1.666211680
   38   3.6000   0.3550   0.000000   2.0300   1.8000   0.025682759  -1.666211680
   39   3.6000   0.3550  -0.007500   2.0300   1.8000   0.025682759  -1.666211680
   40   3.5000   0.0660  -0.112500   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   3.5000   0.0660   0.150000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.300000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.6000   0.3550  -0.900000   2.0300   1.8000   0.025682759  -1.666211680
   47   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   49   3.3000   0.1700  -0.630000   1.9050   1.6860   0.051222218  -2.220205820
   50   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660   0.030000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0150   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    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   166.000  2.038
   33    37   166.000  2.038
   37    38   166.000  2.038
   38    39   166.000  2.038
   39    40   222.000  1.810
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   268.000  1.529
   43    44   340.000  1.090
   43    45   268.000  1.529
   43    49   382.000  1.448
   45    46   222.000  1.810
   45    47   340.000  1.090
   45    48   340.000  1.090
   49    50   382.000  1.448
   49    54   382.000  1.448
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   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    68.00000  103.70000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    80.00000  101.00000
   33    37    38    80.00000  101.00000
   37    38    39    80.00000  101.00000
   38    39    40    68.00000  103.70000
   39    40    41    35.00000  109.50000
   39    40    42    35.00000  109.50000
   39    40    43    75.00000  111.63000
   40    43    44    37.50000  110.70000
   40    43    45    58.35000  112.70000
   40    43    49    56.20000  109.47000
   42    40    41    33.00000  107.80000
   43    40    41    37.50000  110.70000
   43    40    42    37.50000  110.70000
   43    45    46    75.00000  111.63000
   43    45    47    37.50000  110.70000
   43    45    48    37.50000  110.70000
   43    49    50    51.80000  107.20000
   43    49    54    51.80000  107.20000
   45    43    44    37.50000  110.70000
   47    45    46    35.00000  109.50000
   48    45    46    35.00000  109.50000
   48    45    47    33.00000  107.80000
   49    43    44    35.00000  109.50000
   49    43    45    56.20000  109.47000
   49    50    51    35.00000  109.50000
   49    50    52    35.00000  109.50000
   49    50    53    35.00000  109.50000
   49    54    55    35.00000  109.50000
   49    54    56    35.00000  109.50000
   49    54    57    35.00000  109.50000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   54    49    50    51.80000  107.20000
   56    54    55    33.00000  107.80000
   57    54    55    33.00000  107.80000
   57    54    56    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   0.97050  1.0 1.0
   20    24    29    33  -0.41800 -1.0 2.0
   20    24    29    33   0.46750  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  -3.49700 -1.0 2.0
   24    29    33    37   0.74750  1.0 3.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38  -3.49700 -1.0 2.0
   29    33    37    38   0.74750  1.0 3.0
   33    37    38    39  -3.49700 -1.0 2.0
   33    37    38    39   0.74750  1.0 3.0
   37    38    39    40  -3.49700 -1.0 2.0
   37    38    39    40   0.74750  1.0 3.0
   38    39    40    41   0.24000  1.0 3.0
   38    39    40    42   0.24000  1.0 3.0
   38    39    40    43   0.09450  1.0 1.0
   38    39    40    43  -0.17100 -1.0 2.0
   38    39    40    43   0.39100  1.0 3.0
   39    40    43    44   0.15000  1.0 3.0
   39    40    43    45   0.44750  1.0 1.0
   39    40    43    45  -0.17800 -1.0 2.0
   39    40    43    45   0.20200  1.0 3.0
   39    40    43    49   0.56750  1.0 1.0
   39    40    43    49  -0.07550 -1.0 2.0
   39    40    43    49   0.20000  1.0 3.0
   40    43    45    46   0.44750  1.0 1.0
   40    43    45    46  -0.17800 -1.0 2.0
   40    43    45    46   0.20200  1.0 3.0
   40    43    45    47   0.15000  1.0 3.0
   40    43    45    48   0.15000  1.0 3.0
   40    43    49    50   0.23450  1.0 1.0
   40    43    49    50   0.02050 -1.0 2.0
   40    43    49    50   0.25250  1.0 3.0
   40    43    49    54   0.23450  1.0 1.0
   40    43    49    54   0.02050 -1.0 2.0
   40    43    49    54   0.25250  1.0 3.0
   41    40    43    44   0.15000  1.0 3.0
   41    40    43    45   0.15000  1.0 3.0
   41    40    43    49   0.15000  1.0 3.0
   42    40    43    44   0.15000  1.0 3.0
   42    40    43    45   0.15000  1.0 3.0
   42    40    43    49   0.15000  1.0 3.0
   43    49    50    51   0.28000  1.0 3.0
   43    49    50    52   0.28000  1.0 3.0
   43    49    50    53   0.28000  1.0 3.0
   43    49    54    55   0.28000  1.0 3.0
   43    49    54    56   0.28000  1.0 3.0
   43    49    54    57   0.28000  1.0 3.0
   44    43    45    46   0.15000  1.0 3.0
   44    43    45    47   0.15000  1.0 3.0
   44    43    45    48   0.15000  1.0 3.0
   44    43    49    50   0.28000  1.0 3.0
   44    43    49    54   0.28000  1.0 3.0
   45    43    49    50   0.23450  1.0 1.0
   45    43    49    50   0.02050 -1.0 2.0
   45    43    49    50   0.25250  1.0 3.0
   45    43    49    54   0.23450  1.0 1.0
   45    43    49    54   0.02050 -1.0 2.0
   45    43    49    54   0.25250  1.0 3.0
   49    43    45    46   0.56750  1.0 1.0
   49    43    45    46  -0.07550 -1.0 2.0
   49    43    45    46   0.20000  1.0 3.0
   49    43    45    47   0.15000  1.0 3.0
   49    43    45    48   0.15000  1.0 3.0
   50    49    54    55   0.28000  1.0 3.0
   50    49    54    56   0.28000  1.0 3.0
   50    49    54    57   0.28000  1.0 3.0
   54    49    50    51   0.28000  1.0 3.0
   54    49    50    52   0.28000  1.0 3.0
   54    49    50    53   0.28000  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
END
