* LIGAND DATABASE FILE (OPLS2005)
*
001      56    58    109    181     321
    1     0 S   NP   _N1_     1    28.53066    94.63211   -22.70033
    2     1 S   H    _HN1     2     1.02961    85.50920    32.11847
    3     1 S   H    _H1_     3     1.02839    27.55278   173.91501
    4     1 S   H    _H2_     4     1.02778    99.64759   -75.73331
    5     1 S   CT   _CA1     5     1.50110   136.21435   147.18518
    6     5 S   HC   _HA1     6     1.09575   105.24726    71.98818
    7     5 S   CO3  _C1_     7     1.53791   112.36178   -48.24868
    8     7 S   O2Z  _O11     8     1.26358   115.00159   -44.55943
    9     7 S   O2Z  _O12     9     1.26236   114.91489   134.64012
   10     5 S   CT   _CB1    10     1.53099   107.44108  -170.09881
   11    10 S   HC   HB11    11     1.09824   109.35964   -50.89616
   12    10 S   HC   HB12    12     1.09820   110.40541    65.65598
   13    10 S   CT   _CG1    13     1.53010   112.66290  -172.00692
   14    13 S   HC   HG11    14     1.09601   110.41961   -63.11688
   15    13 S   HC   HG12    15     1.09648   110.01749    56.10609
   16    13 S   C    _CD1    16     1.51810   112.31626   176.47497
   17    16 S   O    _OE1    17     1.22721   123.27943    -3.28014
   18    16 S   N    _N2_    18     1.38617   111.63163   176.84012
   19    18 S   H    _HN2    19     1.01598   119.01272     1.13125
   20    18 S   CT1  _CA2    20     1.46212   123.39996  -179.23947
   21    20 S   HC   _HA2    21     1.09732   109.40130   -11.04373
   22    20 S   C    _C2_    22     1.53421   108.35437  -126.72851
   23    22 S   O    _O2_    23     1.23015   122.23038  -145.80906
   24    20 S   CT   _CB2    32     1.53352   111.42229   111.04815
   25    24 S   HC   HB21    33     1.09595   109.72818    55.50245
   26    24 S   HC   HB22    34     1.09548   110.40130   173.97380
   27    22 S   N    _N3_    24     1.38501   113.39578    41.55683
   28    27 S   H    _HN3    25     1.01520   118.94681    -0.58383
   29    24 S   S    _SG2    35     1.82410   111.81569   -65.76748
   30    27 S   CT   _CA3    26     1.45448   123.43896   175.13325
   31    30 S   HC   HA31    27     1.09523   109.25319    24.24889
   32    30 S   HC   HA32    28     1.09496   107.12149   141.25302
   33    29 S   CM   _C11    36     1.71237   100.09166   173.16545
   34    30 S   CO3  _C3_    29     1.52920   113.09031   -99.23856
   35    34 S   O2Z  _O31    30     1.26405   115.39487   -44.83979
   36    34 S   O2Z  _O32    31     1.26353   114.99321   136.10169
   37    33 S   CM   _C10    37     1.34321   127.35249    85.59660
   38    37 S   Cl   Cl4_    38     1.69693   128.34416    -0.12195
   39    33 S   CT   _C12    52     1.52816   126.15148   -97.97375
   40    39 S   Cl   Cl3_    53     1.75508   116.42101    23.13599
   41    37 S   CT   _C9_    39     1.51859   107.89435   176.86943
   42    41 S   Cl   Cl5_    40     1.75284   116.57555   160.26550
   43    41 S   CT   _C13    54     1.56053    99.07790    36.03561
   44    43 S   Cl   Cl1_    55     1.79457   114.62344  -171.99094
   45    43 S   Cl   Cl2_    56     1.80326   114.54888    64.85006
   46    41 S   CT   _C8_    41     1.56608   108.16557   -69.95785
   47    46 S   HC   _H5_    42     1.09689   112.01361  -173.87855
   48    46 S   CM   _C4_    43     1.49485   117.96905   -45.39271
   49    48 S   HC   _H6_    44     1.08116   123.64557   -65.67988
   50    48 S   CM   _C5_    45     1.33725   112.23827   114.33656
   51    50 S   HC   _H7_    46     1.08182   123.51311  -179.62570
   52    50 S   CT   _C6_    47     1.49625   113.29477     0.14265
   53    52 S   Cl   Cl6_    48     1.78312   108.87811   116.64633
   54    52 S   HC   _H3_    49     1.09144   112.15202  -124.95954
   55    46 S   CT   _C7_    50     1.57217   102.71071    67.87498
   56    55 S   HC   _H4_    51     1.09827   109.38917   114.17083
  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   8   5   4   3
  13   2   1   1  12   5  15   8  12   7   8   3   2  10   6   8
   4   6   4   4   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    41    55    39    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    41    42    46    52    55    56    39    40    43    44    45  
   35    36  
   36  
    0  
   38    41    42    46    47    48    55    39    40    43    44    45  
   41    42    46    39    43  
   40    43    44    45    41    42    46    47    48    50    52    53    54    55    56  
   43    44    45    41    46    52    55    56  
   42    46    47    48    49    50    52    55    56    43    44    45  
   46    47    48    55    43    44    45  
   44    45    46    47    48    52    55    56  
   45    46    55  
   46    55  
   47    48    49    50    51    52    53    54    55    56  
   48    49    50    52    55    56  
   49    50    51    52    53    54    55    56  
   50    51    52    55  
   51    52    53    54    55    56  
   52    53    54    55  
   53    54    55    56  
   54    55    56  
   55    56  
   56  
    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   3.5500   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   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   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   39   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   41   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   43   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   44   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   45   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   53   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   54   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   56   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   240.000  1.763
   33    37   549.000  1.340
   33    39   317.000  1.510
   37    38   300.000  1.725
   37    41   317.000  1.510
   41    42   245.000  1.781
   41    46   268.000  1.529
   41    43   268.000  1.529
   46    47   340.000  1.090
   46    48   317.000  1.510
   46    55   268.000  1.529
   48    49   340.000  1.080
   48    50   549.000  1.340
   50    51   340.000  1.080
   50    52   317.000  1.510
   52    53   245.000  1.781
   52    54   340.000  1.090
   52    55   268.000  1.529
   55    56   340.000  1.090
   55    39   268.000  1.529
   39    40   245.000  1.781
   39    43   268.000  1.529
   43    44   245.000  1.781
   43    45   245.000  1.781
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    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    65.00000  122.11800
   29    33    39    65.00000  117.37300
   33    37    38    75.00000  121.50000
   33    37    41    70.00000  124.00000
   33    39    55    70.00000  112.02700
   33    39    40    75.00000  111.90500
   33    39    43    70.00000  112.02700
   37    41    42    75.00000  111.90500
   37    41    46    70.00000  112.02700
   37    41    43    70.00000  112.02700
   41    37    38    75.00000  111.02000
   41    46    47    37.50000  110.70000
   41    46    48    70.00000  112.02700
   41    46    55    58.35000  112.70000
   41    43    39    58.35000  112.70000
   41    43    44    69.00000  109.80000
   41    43    45    69.00000  109.80000
   46    41    42    69.00000  109.80000
   46    48    49    35.00000  117.00000
   46    48    50    70.00000  124.00000
   46    55    52    58.35000  112.70000
   46    55    56    37.50000  110.70000
   46    55    39    58.35000  112.70000
   48    46    47    35.00000  109.50000
   48    50    51    35.00000  120.00000
   48    50    52    70.00000  124.00000
   50    48    49    35.00000  120.00000
   50    52    53    75.00000  111.90500
   50    52    54    35.00000  109.50000
   50    52    55    70.00000  112.02700
   52    50    51    35.00000  117.00000
   52    55    56    37.50000  110.70000
   52    55    39    58.35000  112.70000
   54    52    53    51.00000  107.60000
   55    46    47    37.50000  110.70000
   55    46    48    70.00000  112.02700
   55    52    53    69.00000  109.80000
   55    52    54    37.50000  110.70000
   55    39    40    69.00000  109.80000
   55    39    43    58.35000  112.70000
   39    33    37    70.00000  124.00000
   39    55    56    37.50000  110.70000
   39    43    44    69.00000  109.80000
   39    43    45    69.00000  109.80000
   43    41    42    69.00000  109.80000
   43    41    46    58.35000  112.70000
   43    39    40    69.00000  109.80000
   45    43    44    80.00000  110.42200
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   0.00000  1.0 1.0
   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   1.00000 -1.0 2.0
   24    29    33    39   1.00000 -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   7.00000 -1.0 2.0
   29    33    37    41   7.00000 -1.0 2.0
   29    33    39    55   0.09700  1.0 1.0
   29    33    39    55   0.15600 -1.0 2.0
   29    33    39    55  -0.50800  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    43   0.09700  1.0 1.0
   29    33    39    43   0.15600 -1.0 2.0
   29    33    39    43  -0.50800  1.0 3.0
   33    37    41    42   0.09700  1.0 1.0
   33    37    41    42   0.15600 -1.0 2.0
   33    37    41    42  -0.50800  1.0 3.0
   33    37    41    46   0.09850  1.0 1.0
   33    37    41    46   0.15250 -1.0 2.0
   33    37    41    46  -0.50650  1.0 3.0
   33    37   -41    43   0.09850  1.0 1.0
   33    37   -41    43   0.15250 -1.0 2.0
   33    37   -41    43  -0.50650  1.0 3.0
   33    39   -43    41   0.34400  1.0 1.0
   33    39   -43    41   0.09450 -1.0 2.0
   33    39   -43    41   0.11100  1.0 3.0
   33    39    43    44   0.56750  1.0 1.0
   33    39    43    44  -0.07550 -1.0 2.0
   33    39    43    44   0.20000  1.0 3.0
   33    39    43    45   0.56750  1.0 1.0
   33    39    43    45  -0.07550 -1.0 2.0
   33    39    43    45   0.20000  1.0 3.0
   37    33    39    55   0.09850  1.0 1.0
   37    33    39    55   0.15250 -1.0 2.0
   37    33    39    55  -0.50650  1.0 3.0
   37    33    39    40   0.09700  1.0 1.0
   37    33    39    40   0.15600 -1.0 2.0
   37    33    39    40  -0.50800  1.0 3.0
   37    33   -39    43   0.09850  1.0 1.0
   37    33   -39    43   0.15250 -1.0 2.0
   37    33   -39    43  -0.50650  1.0 3.0
   37    41    46    47   0.15000  1.0 3.0
   37    41    46    48   0.31000  1.0 1.0
   37    41    46    48   0.14700 -1.0 2.0
   37    41    46    48   0.07550  1.0 3.0
   37    41   -46    55   0.34400  1.0 1.0
   37    41   -46    55   0.09450 -1.0 2.0
   37    41   -46    55   0.11100  1.0 3.0
   37    41   -43    39   0.34400  1.0 1.0
   37    41   -43    39   0.09450 -1.0 2.0
   37    41   -43    39   0.11100  1.0 3.0
   37    41    43    44   0.56750  1.0 1.0
   37    41    43    44  -0.07550 -1.0 2.0
   37    41    43    44   0.20000  1.0 3.0
   37    41    43    45   0.56750  1.0 1.0
   37    41    43    45  -0.07550 -1.0 2.0
   37    41    43    45   0.20000  1.0 3.0
   38    37    41    42   0.09700  1.0 1.0
   38    37    41    42   0.15600 -1.0 2.0
   38    37    41    42  -0.50800  1.0 3.0
   38    37    41    46   0.09700  1.0 1.0
   38    37    41    46   0.15600 -1.0 2.0
   38    37    41    46  -0.50800  1.0 3.0
   38    37    41    43   0.09700  1.0 1.0
   38    37    41    43   0.15600 -1.0 2.0
   38    37    41    43  -0.50800  1.0 3.0
   41    46    48    49   0.00000  1.0 1.0
   41    46    48    50   0.09850  1.0 1.0
   41    46    48    50   0.15250 -1.0 2.0
   41    46    48    50  -0.50650  1.0 3.0
   41    46    55    52   0.56750  1.0 1.0
   41    46    55    52  -0.07550 -1.0 2.0
   41    46    55    52   0.20000  1.0 3.0
   41    46    55    56   0.15000  1.0 3.0
   41    46   -55    39   0.56750  1.0 1.0
   41    46   -55    39  -0.07550 -1.0 2.0
   41    46   -55    39   0.20000  1.0 3.0
   42    41    46    47   0.27000  1.0 3.0
   42    41    46    48   0.56750  1.0 1.0
   42    41    46    48  -0.07550 -1.0 2.0
   42    41    46    48   0.20000  1.0 3.0
   42    41    46    55   0.35600  1.0 1.0
   42    41    46    55  -0.14650 -1.0 2.0
   42    41    46    55   0.33350  1.0 3.0
   42    41    43    39   0.35600  1.0 1.0
   42    41    43    39  -0.14650 -1.0 2.0
   42    41    43    39   0.33350  1.0 3.0
   42    41    43    44   0.22500  1.0 1.0
   42    41    43    45   0.22500  1.0 1.0
   46    41   -43    39   0.56750  1.0 1.0
   46    41   -43    39  -0.07550 -1.0 2.0
   46    41   -43    39   0.20000  1.0 3.0
   46    41    43    44   0.35600  1.0 1.0
   46    41    43    44  -0.14650 -1.0 2.0
   46    41    43    44   0.33350  1.0 3.0
   46    41    43    45   0.35600  1.0 1.0
   46    41    43    45  -0.14650 -1.0 2.0
   46    41    43    45   0.33350  1.0 3.0
   46    48    50    51   7.00000 -1.0 2.0
   46    48   -50    52   7.00000 -1.0 2.0
   46    55   -39    33   0.34400  1.0 1.0
   46    55   -39    33   0.09450 -1.0 2.0
   46    55   -39    33   0.11100  1.0 3.0
   46    55    39    40   0.35600  1.0 1.0
   46    55    39    40  -0.14650 -1.0 2.0
   46    55    39    40   0.33350  1.0 3.0
   46    55   -39    43   0.56750  1.0 1.0
   46    55   -39    43  -0.07550 -1.0 2.0
   46    55   -39    43   0.20000  1.0 3.0
   47    46    48    49   0.33100  1.0 3.0
   47    46    48    50   0.00000  1.0 1.0
   47    46    55    52   0.15000  1.0 3.0
   47    46    55    56   0.15000  1.0 3.0
   47    46    55    39   0.15000  1.0 3.0
   48    46   -55    52   0.34400  1.0 1.0
   48    46   -55    52   0.09450 -1.0 2.0
   48    46   -55    52   0.11100  1.0 3.0
   48    46    55    56   0.15000  1.0 3.0
   48    46    55    39   0.34400  1.0 1.0
   48    46    55    39   0.09450 -1.0 2.0
   48    46    55    39   0.11100  1.0 3.0
   48    50    52    53   0.09700  1.0 1.0
   48    50    52    53   0.15600 -1.0 2.0
   48    50    52    53  -0.50800  1.0 3.0
   48    50    52    54   0.00000  1.0 1.0
   48    50   -52    55   0.09850  1.0 1.0
   48    50   -52    55   0.15250 -1.0 2.0
   48    50   -52    55  -0.50650  1.0 3.0
   49    48    50    51   7.00000 -1.0 2.0
   49    48    50    52   7.00000 -1.0 2.0
   50    52   -55    46   0.34400  1.0 1.0
   50    52   -55    46   0.09450 -1.0 2.0
   50    52   -55    46   0.11100  1.0 3.0
   50    52    55    56   0.15000  1.0 3.0
   50    52    55    39   0.34400  1.0 1.0
   50    52    55    39   0.09450 -1.0 2.0
   50    52    55    39   0.11100  1.0 3.0
   51    50    52    53   0.00000  1.0 1.0
   51    50    52    54   0.33100  1.0 3.0
   51    50    52    55   0.00000  1.0 1.0
   52    55    39    33   0.34400  1.0 1.0
   52    55    39    33   0.09450 -1.0 2.0
   52    55    39    33   0.11100  1.0 3.0
   52    55    39    40   0.35600  1.0 1.0
   52    55    39    40  -0.14650 -1.0 2.0
   52    55    39    40   0.33350  1.0 3.0
   52    55    39    43   0.56750  1.0 1.0
   52    55    39    43  -0.07550 -1.0 2.0
   52    55    39    43   0.20000  1.0 3.0
   53    52    55    46   0.35600  1.0 1.0
   53    52    55    46  -0.14650 -1.0 2.0
   53    52    55    46   0.33350  1.0 3.0
   53    52    55    56   0.27000  1.0 3.0
   53    52    55    39   0.35600  1.0 1.0
   53    52    55    39  -0.14650 -1.0 2.0
   53    52    55    39   0.33350  1.0 3.0
   54    52    55    46   0.15000  1.0 3.0
   54    52    55    56   0.15000  1.0 3.0
   54    52    55    39   0.15000  1.0 3.0
   55    46    48    49   0.00000  1.0 1.0
   55    46   -48    50   0.09850  1.0 1.0
   55    46   -48    50   0.15250 -1.0 2.0
   55    46   -48    50  -0.50650  1.0 3.0
   55    39   -43    41   0.56750  1.0 1.0
   55    39   -43    41  -0.07550 -1.0 2.0
   55    39   -43    41   0.20000  1.0 3.0
   55    39    43    44   0.35600  1.0 1.0
   55    39    43    44  -0.14650 -1.0 2.0
   55    39    43    44   0.33350  1.0 3.0
   55    39    43    45   0.35600  1.0 1.0
   55    39    43    45  -0.14650 -1.0 2.0
   55    39    43    45   0.33350  1.0 3.0
   56    55    39    33   0.15000  1.0 3.0
   56    55    39    40   0.27000  1.0 3.0
   56    55    39    43   0.15000  1.0 3.0
   39    33    37    38   7.00000 -1.0 2.0
   39    33   -37    41   7.00000 -1.0 2.0
   40    39    43    41   0.35600  1.0 1.0
   40    39    43    41  -0.14650 -1.0 2.0
   40    39    43    41   0.33350  1.0 3.0
   40    39    43    44   0.22500  1.0 1.0
   40    39    43    45   0.22500  1.0 1.0
   43    41    46    47   0.15000  1.0 3.0
   43    41    46    48   0.34400  1.0 1.0
   43    41    46    48   0.09450 -1.0 2.0
   43    41    46    48   0.11100  1.0 3.0
   43    41   -46    55   0.56750  1.0 1.0
   43    41   -46    55  -0.07550 -1.0 2.0
   43    41   -46    55   0.20000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   35    30    34    36  10.50000 -1.0 2.0
   29    39    33    37   1.10000 -1.0 2.0
   41    38    37    33   1.10000 -1.0 2.0
   46    49    48    50   1.10000 -1.0 2.0
   52    51    50    48   1.10000 -1.0 2.0
END
