* LIGAND DATABASE FILE (OPLS2005)
*
001      63    63    106    163     310
    1     0 S   NP   _N1_     1    28.27191    96.56731   -23.25925
    2     1 S   H    _HN1     2     1.02776   107.58632  -105.42711
    3     1 S   H    _H1_     3     1.02957    74.55100    -0.66234
    4     1 S   H    _H2_     4     1.02835    34.69115   158.34687
    5     1 S   CT   _CA1     5     1.50126   135.07238   102.91134
    6     5 S   HC   _HA1     6     1.09574   105.22162    89.25133
    7     5 S   CO3  _C1_     7     1.53789   112.37287   -30.95767
    8     7 S   O2Z  _O11     8     1.26366   114.99599   -43.68360
    9     7 S   O2Z  _O12     9     1.26235   114.93356   135.44350
   10     5 S   CT   _CB1    10     1.53098   107.42613  -152.82047
   11    10 S   HC   HB11    11     1.09826   109.34894   -50.43815
   12    10 S   HC   HB12    12     1.09816   110.41813    66.12340
   13    10 S   CT   _CG1    13     1.53014   112.66495  -171.50719
   14    13 S   HC   HG11    14     1.09595   110.49105   -64.14692
   15    13 S   HC   HG12    15     1.09656   109.92317    55.05361
   16    13 S   C    _CD1    16     1.51836   112.32601   175.44009
   17    16 S   O    _OE1    17     1.22744   123.29421     0.14265
   18    16 S   N    _N2_    18     1.38550   111.68584  -179.89165
   19    18 S   H    _HN2    19     1.01565   119.00609     4.71094
   20    18 S   CT1  _CA2    20     1.45878   122.91541   178.11695
   21    20 S   HC   _HA2    21     1.09701   109.02858    23.62446
   22    20 S   C    _C2_    22     1.52831   106.58720   -93.82238
   23    22 S   O    _O2_    23     1.23014   122.80875   -32.52438
   24    20 S   CT   _CB2    32     1.53172   112.10080   146.94517
   25    24 S   HC   HB21    33     1.09468   109.64828    54.92336
   26    24 S   HC   HB22    34     1.09466   109.83644   173.57624
   27    22 S   N    _N3_    24     1.38446   112.78159   150.15719
   28    27 S   H    _HN3    25     1.01667   120.41162    -0.70638
   29    24 S   S    _SG2    35     1.82736   110.82165   -66.31347
   30    27 S   CT   _CA3    26     1.45377   122.37407   178.68672
   31    30 S   HC   HA31    27     1.09560   107.36745   -67.21125
   32    30 S   HC   HA32    28     1.09575   108.05867    49.11481
   33    29 S   CT   _C17    36     1.85176   101.06620   168.39485
   34    33 S   Cl   Cl2_    37     1.81902   107.96632   175.51114
   35    33 S   Cl   Cl3_    38     1.81759   106.67393   -72.72897
   36    30 S   CO3  _C3_    29     1.52874   114.47355   171.34165
   37    36 S   O2Z  _O31    30     1.26308   116.11740     2.72218
   38    36 S   O2Z  _O32    31     1.26464   114.37242  -177.18742
   39    33 S   CM   _C10    39     1.54010   113.88982    54.70100
   40    39 S   CA   _C9_    40     1.48784   116.31589  -130.16077
   41    39 S   CMA  _C11    51     1.36889   124.16554    54.61925
   42    41 S   OM   _O36    52     1.26340   131.32664     0.18023
   43    40 S   CA   _C4_    41     1.40314   119.72657   -90.14590
   44    43 S   HA   _H3_    42     1.08750   120.48382     0.04423
   45    41 S   CM   _C12    53     1.46954   120.76173   178.80221
   46    45 S   HC   _H7_    54     1.08992   115.83394  -106.81004
   47    43 S   CA   _C5_    43     1.39555   120.34663  -179.44680
   48    47 S   HA   _H4_    44     1.08640   119.37779   179.63631
   49    45 S   CM   _C13    55     1.34557   124.30174    74.51935
   50    49 S   HC   _H8_    56     1.08783   119.48332     1.87095
   51    47 S   CA   _C6_    45     1.39410   119.70755     0.13848
   52    51 S   Cl   Cl4_    46     1.72218   119.72892   179.96574
   53    49 S   CM   _C14    57     1.45597   125.04050   179.51989
   54    53 S   Cl   Cl1_    58     1.74815   112.71741  -127.95993
   55    51 S   CA   _C7_    47     1.39418   120.55786    -0.04846
   56    55 S   HA   _H5_    48     1.08646   120.89610   179.57572
   57    53 S   CMA  _C15    59     1.35534   124.46852    54.92732
   58    57 S   OM   _O35    60     1.26512   133.26083    -0.52302
   59    40 S   CA   _C8_    49     1.40249   120.94593    90.57898
   60    59 S   HA   _H6_    50     1.08654   120.66514     0.10468
   61    57 S   CO3  _C16    61     1.55925   114.89926   178.94612
   62    61 S   O2Z  _O34    62     1.26802   115.32399    88.80891
   63    61 S   O2Z  _O33    63     1.26807   115.36448   -90.58113
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   6   5   4   3
   9   4   3   2   1   1  12  12   8   3   8   4   6   3   6   3
   6   3   5   3   6   3   3   2   4   3   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    43    59    41    42    45  
   35    39    40    41  
   39    40    41  
   37    38  
   38  
    0  
   40    43    44    47    55    59    60    41    42    45    46    49  
   43    44    47    48    51    55    56    59    60    41    42    45  
   42    45    46    49    50    53    43    59  
   45    46    49  
   44    47    48    51    52    55    59    60  
   47    48    51    59  
   46    49    50    53    54    57  
   49    50    53  
   48    51    52    55    56    59  
   51    52    55  
   50    53    54    57    58    61  
   53    54    57  
   52    55    56    59    60  
   55    56    59  
   54    57    58    61    62    63  
   57    58    61  
   56    59    60  
   59    60  
   58    61    62    63  
   61    62    63  
   60  
    0  
   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  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.279100   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   35   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   44   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   45   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   46   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   52   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   53   3.5500   0.0760  -0.481200   2.0020   1.7750   0.023028004  -0.852763146
   54   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   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   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   58   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   62   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   245.000  1.781
   33    35   245.000  1.781
   33    39   317.000  1.510
   39    40   320.000  1.460
   39    41   465.000  1.376
   40    43   469.000  1.400
   40    59   469.000  1.400
   43    44   367.000  1.080
   43    47   469.000  1.400
   47    48   367.000  1.080
   47    51   469.000  1.400
   51    52   300.000  1.725
   51    55   469.000  1.400
   55    56   367.000  1.080
   55    59   469.000  1.400
   59    60   367.000  1.080
   41    42   745.000  1.250
   41    45   465.000  1.376
   45    46   340.000  1.080
   45    49   549.000  1.340
   49    50   340.000  1.080
   49    53   380.000  1.444
   53    54   300.000  1.725
   53    57   465.000  1.376
   57    58   745.000  1.250
   57    61   230.000  1.545
   61    62   656.000  1.250
   61    63   656.000  1.250
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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    85.00000  110.65400
   29    33    35    85.00000  110.65400
   29    33    39    75.00000  112.20000
   33    39    40    65.00000  118.87000
   33    39    41    70.00000  124.00000
   35    33    34    80.00000  110.42200
   39    33    34    75.00000  111.90500
   39    33    35    75.00000  111.90500
   39    40    43    60.00000  120.93500
   39    40    59    60.00000  120.93500
   39    41    42    65.00000  137.10300
   39    41    45    70.00000  123.01800
   40    43    44    35.00000  120.00000
   40    43    47    63.00000  120.00000
   40    59    55    63.00000  120.00000
   40    59    60    35.00000  120.00000
   43    47    48    35.00000  120.00000
   43    47    51    63.00000  120.00000
   47    43    44    35.00000  120.00000
   47    51    52    75.00000  120.00000
   47    51    55    63.00000  120.00000
   51    47    48    35.00000  120.00000
   51    55    56    35.00000  120.00000
   51    55    59    63.00000  120.00000
   55    51    52    75.00000  120.00000
   55    59    60    35.00000  120.00000
   59    40    43    63.00000  120.00000
   59    55    56    35.00000  120.00000
   41    39    40    60.00000  123.20500
   41    45    46    40.00000  120.50800
   41    45    49    70.00000  117.34000
   45    41    42    65.00000  137.10300
   45    49    50    35.00000  120.00000
   45    49    53    70.00000  123.01800
   49    45    46    35.00000  120.00000
   49    53    54    75.00000  121.50000
   49    53    57    70.00000  117.34000
   53    49    50    35.00000  120.00000
   53    57    58    65.00000  137.10300
   53    57    61    55.00000  124.75400
   57    53    54    60.00000  123.80000
   57    61    62    85.00000  113.83300
   57    61    63    85.00000  113.83300
   61    57    58    65.00000  121.00000
   63    61    62    80.00000  126.00000
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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    35   0.01700  1.0 1.0
   24    29    33    35  -0.23550 -1.0 2.0
   24    29    33    35   0.21350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    39    40   0.09700  1.0 1.0
   29    33    39    40   0.15600 -1.0 2.0
   29    33    39    40  -0.50800  1.0 3.0
   29    33    39    41   0.42700  1.0 1.0
   29    33    39    41  -0.70350 -1.0 2.0
   29    33    39    41  -0.43150  1.0 3.0
   33    39    40    43  -0.02500  1.0 1.0
   33    39    40    43  -0.32150 -1.0 2.0
   33    39    40    43  -0.01500  1.0 3.0
   33    39    40    59  -0.02500  1.0 1.0
   33    39    40    59  -0.32150 -1.0 2.0
   33    39    40    59  -0.01500  1.0 3.0
   33    39    41    42   7.00000 -1.0 2.0
   33    39    41    45   7.00000 -1.0 2.0
   34    33    39    40   0.09700  1.0 1.0
   34    33    39    40   0.15600 -1.0 2.0
   34    33    39    40  -0.50800  1.0 3.0
   34    33    39    41   0.09700  1.0 1.0
   34    33    39    41   0.15600 -1.0 2.0
   34    33    39    41  -0.50800  1.0 3.0
   35    33    39    40   0.09700  1.0 1.0
   35    33    39    40   0.15600 -1.0 2.0
   35    33    39    40  -0.50800  1.0 3.0
   35    33    39    41   0.09700  1.0 1.0
   35    33    39    41   0.15600 -1.0 2.0
   35    33    39    41  -0.50800  1.0 3.0
   39    40    43    44   3.62500 -1.0 2.0
   39    40    43    47   3.62500 -1.0 2.0
   39    40    59    55   3.62500 -1.0 2.0
   39    40    59    60   3.62500 -1.0 2.0
   39    41    45    46   7.00000 -1.0 2.0
   39    41    45    49   7.00000 -1.0 2.0
   40    39    41    42   7.00000 -1.0 2.0
   40    39    41    45   7.00000 -1.0 2.0
   40    43    47    48   3.62500 -1.0 2.0
   40    43    47    51   3.62500 -1.0 2.0
   43    40    59    55   3.62500 -1.0 2.0
   43    40    59    60   3.62500 -1.0 2.0
   43    47    51    52   3.62500 -1.0 2.0
   43    47   -51    55   3.62500 -1.0 2.0
   44    43    47    48   3.62500 -1.0 2.0
   44    43    47    51   3.62500 -1.0 2.0
   47    51    55    56   3.62500 -1.0 2.0
   47    51    55    59   3.62500 -1.0 2.0
   48    47    51    52   3.62500 -1.0 2.0
   48    47    51    55   3.62500 -1.0 2.0
   51    55   -59    40   3.62500 -1.0 2.0
   51    55    59    60   3.62500 -1.0 2.0
   52    51    55    56   3.62500 -1.0 2.0
   52    51    55    59   3.62500 -1.0 2.0
   56    55    59    40   3.62500 -1.0 2.0
   56    55    59    60   3.62500 -1.0 2.0
   59    40    43    44   3.62500 -1.0 2.0
   59    40   -43    47   3.62500 -1.0 2.0
   41    39    40    43   0.15800  1.0 1.0
   41    39    40    43   1.85350 -1.0 2.0
   41    39    40    43  -0.48700  1.0 3.0
   41    39    40    59   0.15800  1.0 1.0
   41    39    40    59   1.85350 -1.0 2.0
   41    39    40    59  -0.48700  1.0 3.0
   41    45    49    50   7.00000 -1.0 2.0
   41    45    49    53   7.00000 -1.0 2.0
   42    41    45    46   7.00000 -1.0 2.0
   42    41    45    49   7.00000 -1.0 2.0
   45    49    53    54  -0.18600  1.0 3.0
   45    49    53    57   0.28850  1.0 1.0
   45    49    53    57   2.61350 -1.0 2.0
   45    49    53    57   0.78400  1.0 3.0
   46    45    49    50   7.00000 -1.0 2.0
   46    45    49    53   7.00000 -1.0 2.0
   49    53    57    58   7.00000 -1.0 2.0
   49    53    57    61   7.00000 -1.0 2.0
   50    49    53    54   0.00000  1.0 1.0
   50    49    53    57  -0.18600  1.0 3.0
   53    57    61    62  -0.04000 -1.0 2.0
   53    57    61    62  -0.29050  1.0 3.0
   53    57    61    63  -0.04000 -1.0 2.0
   53    57    61    63  -0.29050  1.0 3.0
   54    53    57    58   7.00000 -1.0 2.0
   54    53    57    61   7.00000 -1.0 2.0
   58    57    61    62   1.68800 -1.0 2.0
   58    57    61    63   1.68800 -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
   37    30    36    38  10.50000 -1.0 2.0
   33    40    39    41  15.00000 -1.0 2.0
   43    59    40    39   4.00000 -1.0 2.0
   47    44    43    40   1.10000 -1.0 2.0
   51    48    47    43   1.10000 -1.0 2.0
   55    52    51    47   4.00000 -1.0 2.0
   59    56    55    51   1.10000 -1.0 2.0
   55    60    59    40   1.10000 -1.0 2.0
   45    42    41    39  15.00000 -1.0 2.0
   41    46    45    49  15.00000 -1.0 2.0
   53    50    49    45  15.00000 -1.0 2.0
   49    54    53    57  15.00000 -1.0 2.0
   61    58    57    53  15.00000 -1.0 2.0
   62    57    61    63  10.50000 -1.0 2.0
END
