* LIGAND DATABASE FILE (OPLS2005)
*
001      57    57     98    133     274
    1     0 S   NP   _N1_     1    28.80836    96.17605   -22.86456
    2     1 S   H    _HN1     2     1.02950    72.65915    13.75123
    3     1 S   H    _H1_     3     1.02829    38.97735   164.78696
    4     1 S   H    _H2_     4     1.02786   102.29782   -91.89873
    5     1 S   CT   _CA1     5     1.50108   141.37466   114.96396
    6     5 S   HC   _HA1     6     1.09573   105.19865    90.15557
    7     5 S   CO3  _C1_     7     1.53788   112.46747   -30.08868
    8     7 S   O2Z  _O11     8     1.26371   115.00733   -42.55159
    9     7 S   O2Z  _O12     9     1.26240   114.94556   136.60150
   10     5 S   CT   _CB1    10     1.53082   107.42655  -151.85468
   11    10 S   HC   HB11    11     1.09832   109.37893   -49.72920
   12    10 S   HC   HB12    12     1.09812   110.44654    66.88278
   13    10 S   CT   _CG1    13     1.52988   112.59773  -170.70648
   14    13 S   HC   HG11    14     1.09582   110.62953   -65.56114
   15    13 S   HC   HG12    15     1.09671   109.78629    53.66729
   16    13 S   C    _CD1    16     1.51797   112.23722   174.12964
   17    16 S   O    _OE1    17     1.22727   123.29849     6.89850
   18    16 S   N    _N2_    18     1.38655   111.66237  -173.23581
   19    18 S   H    _HN2    19     1.01586   118.93689     1.76347
   20    18 S   CT1  _CA2    20     1.46209   123.40198   177.40595
   21    20 S   HC   _HA2    21     1.09731   109.36807     2.38392
   22    20 S   C    _C2_    22     1.53559   108.63420  -113.10909
   23    22 S   O    _O2_    23     1.23048   122.30147  -148.75094
   24    20 S   CT   _CB2    32     1.53283   111.55064   124.42310
   25    24 S   HC   HB21    33     1.09636   109.95277    56.22730
   26    24 S   HC   HB22    34     1.09503   110.03748   175.23971
   27    22 S   N    _N3_    24     1.38321   113.74688    38.70989
   28    27 S   H    _HN3    25     1.01583   119.59818    -3.24021
   29    24 S   S    _SG2    35     1.83182   111.43399   -64.80406
   30    27 S   CT   _CA3    26     1.45279   123.19333   177.15876
   31    30 S   HC   HA31    27     1.09549   107.51515   -64.66274
   32    30 S   HC   HA32    28     1.09559   107.98150    51.77407
   33    29 S   CA   _C8_    36     1.79471   101.27594   174.25451
   34    30 S   CO3  _C3_    29     1.52952   114.07764   173.79047
   35    34 S   O2Z  _O31    30     1.26375   116.07235    -0.03956
   36    34 S   O2Z  _O32    31     1.26427   114.40824  -180.00000
   37    33 S   CA   _C6_    37     1.39676   121.74049  -163.79834
   38    37 S   Cl   CL16    38     1.72711   123.35356     0.38917
   39    37 S   CA   _C4_    39     1.39630   118.83921  -179.90935
   40    39 S   HA   _H17    40     1.08774   120.23257  -179.74359
   41    39 S   CA   _C5_    41     1.38995   119.65865     0.17914
   42    41 S   Cl   CL15    42     1.72049   119.72323  -179.87967
   43    41 S   CA   _C7_    43     1.38468   118.07178     0.33455
   44    33 S   NB   _N8_    44     1.35589   116.60343    16.99065
   45    43 S   OS   _O9_    45     1.37798   118.57901  -179.67494
   46    45 S   P1   _P13    46     1.62310   123.22671  -172.71067
   47    46 S   ST   _S14    47     1.94895   116.74114    65.68667
   48    46 S   OS   _O10    48     1.62633   102.12220   -63.50144
   49    46 S   OS   _O33    53     1.62731   101.08868  -167.48866
   50    48 S   CT   _C9_    49     1.41666   119.57521  -168.17082
   51    50 S   HC   _H18    50     1.09285   108.57977  -179.36573
   52    50 S   HC   _H19    51     1.09286   110.12572    61.44719
   53    50 S   HC   _H20    52     1.09225   110.42461   -60.13387
   54    49 S   CT   _C10    54     1.41718   119.60774   -64.86946
   55    54 S   HC   _H21    55     1.09285   108.57078   169.16613
   56    54 S   HC   _H22    56     1.09301   110.59898    49.80488
   57    54 S   HC   _H23    57     1.09266   109.97615   -71.86767
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   6   5   4   3
   8   2   1   1   7   4   6   3   5   3   6   2   6  11   4   6
   5   3   2   1   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    44    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    43    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    43    44    45  
   35    36  
   36  
    0  
   38    39    40    41    42    43    44  
   39    40    41    44  
   40    41    42    43    44    45  
   41    42    43  
   42    43    44    45    46  
   43    44    45  
   44    45    46    47    48    49  
   45    46  
   46    47    48    50    49    54  
   47    48    50    51    52    53    49    54    55    56    57  
   48    50    49    54  
   50    51    52    53    49    54  
   54    55    56    57    50  
   51    52    53  
   52    53  
   53  
    0  
   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   0.047500   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  -0.320000   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   3.5500   0.0700   0.637500   2.5000   1.7750   0.001000000  -0.843144165
   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   3.5500   0.0700  -0.112000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   39   3.5500   0.0700   0.227000   2.0020   1.7750   0.001000000  -0.843144165
   40   2.4200   0.0300   0.065000   1.3810   1.2100   0.030040813   0.268726247
   41   3.5500   0.0700  -0.112000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   43   3.5500   0.0700   0.585000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.2500   0.1700  -0.678000   1.8650   1.6500   0.001000000  -0.511443539
   45   2.8500   0.1400  -0.288200   1.7660   1.5600   0.020110767  -0.896042159
   46   3.7400   0.2000   1.154100   2.1070   1.8700   0.005000000   0.000000000
   47   4.2500   0.5000  -0.589500   2.3875   2.1250   0.025682759  -1.666211680
   48   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   49   2.8500   0.1400  -0.461100   1.5900   1.4000   0.020110767  -0.896042159
   50   3.5000   0.0660   0.092900   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660   0.092900   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   250.000  1.760
   33    37   469.000  1.400
   33    44   483.000  1.339
   37    38   300.000  1.725
   37    39   469.000  1.400
   39    40   367.000  1.080
   39    41   469.000  1.400
   41    42   300.000  1.725
   41    43   469.000  1.400
   43    44   483.000  1.339
   43    45   450.000  1.364
   45    46   405.000  1.623
   46    47   270.000  1.959
   46    48   405.000  1.623
   46    49   405.000  1.623
   48    50   320.000  1.410
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   49    54   320.000  1.410
   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    62.00000  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    44    80.00000  113.48700
   33    37    38    75.00000  120.00000
   33    37    39    63.00000  120.00000
   33    44    43    70.00000  117.00000
   37    39    40    35.00000  120.00000
   37    39    41    63.00000  120.00000
   39    37    38    75.00000  120.00000
   39    41    42    75.00000  120.00000
   39    41    43    63.00000  120.00000
   41    39    40    35.00000  120.00000
   41    43    44    70.00000  124.00000
   41    43    45    70.00000  120.00000
   43    41    42    75.00000  120.00000
   43    45    46    70.00000  122.28900
   44    33    37    70.00000  124.00000
   45    43    44    95.00000  115.10700
   45    46    47    80.00000  117.31900
   45    46    48   120.00000  102.38000
   45    46    49   120.00000  102.38000
   46    48    50    75.00000  119.24600
   46    49    54    75.00000  119.24600
   48    46    47    80.00000  117.31900
   48    50    51    35.00000  109.50000
   48    50    52    35.00000  109.50000
   48    50    53    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
   49    46    47    80.00000  117.31900
   49    46    48   120.00000  102.38000
   49    54    55    35.00000  109.50000
   49    54    56    35.00000  109.50000
   49    54    57    35.00000  109.50000
   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  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  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   0.63250 -1.0 2.0
   24    29    33    44   0.63150 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   3.62500 -1.0 2.0
   29    33    37    39   3.62500 -1.0 2.0
   29    33    44    43   3.62500 -1.0 2.0
   33    37    39    40   3.62500 -1.0 2.0
   33    37    39    41   3.62500 -1.0 2.0
   37    33    44    43   3.62500 -1.0 2.0
   37    39    41    42   3.62500 -1.0 2.0
   37    39   -41    43   3.62500 -1.0 2.0
   38    37    39    40   3.62500 -1.0 2.0
   38    37    39    41   3.62500 -1.0 2.0
   39    41    43    44   3.62500 -1.0 2.0
   39    41    43    45   3.62500 -1.0 2.0
   40    39    41    42   3.62500 -1.0 2.0
   40    39    41    43   3.62500 -1.0 2.0
   41    43   -44    33   3.62500 -1.0 2.0
   41    43    45    46   0.54700 -1.0 2.0
   42    41    43    44   3.62500 -1.0 2.0
   42    41    43    45   3.62500 -1.0 2.0
   43    45    46    47   0.15000  1.0 3.0
   43    45    46    48   0.88300  1.0 1.0
   43    45    46    48   0.16450 -1.0 2.0
   43    45    46    48   0.32850  1.0 3.0
   43    45    46    49   0.88300  1.0 1.0
   43    45    46    49   0.16450 -1.0 2.0
   43    45    46    49   0.32850  1.0 3.0
   44    33    37    38   3.62500 -1.0 2.0
   44    33   -37    39   3.62500 -1.0 2.0
   44    43    45    46   0.00000  1.0 1.0
   45    43    44    33   3.62500 -1.0 2.0
   45    46    48    50   0.91800  1.0 1.0
   45    46    48    50   0.22900 -1.0 2.0
   45    46    48    50   0.32050  1.0 3.0
   45    46    49    54   0.91800  1.0 1.0
   45    46    49    54   0.22900 -1.0 2.0
   45    46    49    54   0.32050  1.0 3.0
   46    48    50    51   0.03000  1.0 3.0
   46    48    50    52   0.03000  1.0 3.0
   46    48    50    53   0.03000  1.0 3.0
   46    49    54    55   0.03000  1.0 3.0
   46    49    54    56   0.03000  1.0 3.0
   46    49    54    57   0.03000  1.0 3.0
   47    46    48    50   0.15000  1.0 3.0
   47    46    49    54   0.15000  1.0 3.0
   48    46    49    54   0.91800  1.0 1.0
   48    46    49    54   0.22900 -1.0 2.0
   48    46    49    54   0.32050  1.0 3.0
   49    46    48    50   0.91800  1.0 1.0
   49    46    48    50   0.22900 -1.0 2.0
   49    46    48    50   0.32050  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
   37    44    33    29   4.00000 -1.0 2.0
   39    38    37    33   4.00000 -1.0 2.0
   41    40    39    37   1.10000 -1.0 2.0
   43    42    41    39   4.00000 -1.0 2.0
   44    45    43    41   4.00000 -1.0 2.0
END
