* LIGAND DATABASE FILE (OPLS2005)
*
001      57    58    103    162     303
    1     0 S   NP   _N1_     1    28.73941    95.73345   -23.17569
    2     1 S   H    _HN1     2     1.02949    76.38639    10.94735
    3     1 S   H    _H1_     3     1.02828    34.18348   164.37383
    4     1 S   H    _H2_     4     1.02787   104.39287   -94.86919
    5     1 S   CT   _CA1     5     1.50112   137.38454   116.40820
    6     5 S   HC   _HA1     6     1.09573   105.19262    85.75171
    7     5 S   CO3  _C1_     7     1.53787   112.47581   -34.48626
    8     7 S   O2Z  _O11     8     1.26372   115.00752   -42.32496
    9     7 S   O2Z  _O12     9     1.26241   114.94787   136.81147
   10     5 S   CT   _CB1    10     1.53077   107.42007  -156.25732
   11    10 S   HC   HB11    11     1.09834   109.37267   -49.63539
   12    10 S   HC   HB12    12     1.09812   110.44786    66.97474
   13    10 S   CT   _CG1    13     1.52991   112.60637  -170.60527
   14    13 S   HC   HG11    14     1.09579   110.64523   -65.81741
   15    13 S   HC   HG12    15     1.09671   109.77173    53.41579
   16    13 S   C    _CD1    16     1.51799   112.20567   173.87984
   17    16 S   O    _OE1    17     1.22730   123.27724     7.63718
   18    16 S   N    _N2_    18     1.38657   111.68776  -172.45272
   19    18 S   H    _HN2    19     1.01575   118.92366     1.77001
   20    18 S   CT1  _CA2    20     1.46204   123.39052   177.29542
   21    20 S   HC   _HA2    21     1.09737   109.38842     3.80725
   22    20 S   C    _C2_    22     1.53587   108.51353  -111.67096
   23    22 S   O    _O2_    23     1.23061   122.30891  -146.96843
   24    20 S   CT   _CB2    32     1.53437   111.68972   125.85323
   25    24 S   HC   HB21    33     1.09516   109.72007    55.99834
   26    24 S   HC   HB22    34     1.09382   109.73031   174.69899
   27    22 S   N    _N3_    24     1.38334   113.70631    40.38718
   28    27 S   H    _HN3    25     1.01577   119.61077    -3.10217
   29    24 S   S    _SG2    35     1.83112   111.28709   -64.31786
   30    27 S   CT   _CA3    26     1.45288   123.21948   177.21463
   31    30 S   HC   HA31    27     1.09549   107.49039   -65.09210
   32    30 S   HC   HA32    28     1.09556   108.00866    51.35111
   33    29 S   CT   _C13    36     1.85296   101.78310  -163.66167
   34    30 S   CO3  _C3_    29     1.52964   114.07900   173.36171
   35    34 S   O2Z  _O31    30     1.26377   116.07768    -0.78559
   36    34 S   O2Z  _O32    31     1.26429   114.41233   179.28099
   37    33 S   CO4  _C11    37     1.52830   110.01490    63.57216
   38    37 S   O    _O13    38     1.22852   123.36158    26.97070
   39    33 S   CT   _C12    51     1.52832   110.12472   -60.22774
   40    39 S   HC   _H19    52     1.09561   112.55323    54.69410
   41    39 S   HC   _H20    53     1.09717   110.57062   -65.90692
   42    33 S   CT   _C14    54     1.53918   105.92358   179.72164
   43    42 S   HC   _H21    55     1.09645   111.80928    61.26380
   44    42 S   HC   _H22    56     1.09723   111.68565   -60.16306
   45    42 S   HC   _H23    57     1.09627   111.53564  -178.81750
   46    37 S   CA   _C9_    39     1.48563   117.50174  -157.16006
   47    46 S   CA   _C7_    40     1.40095   119.14901  -171.01966
   48    47 S   HA   _H18    41     1.08724   121.17644    -1.64853
   49    47 S   CA   _C5_    42     1.39558   120.16643   177.75947
   50    49 S   HA   _H16    43     1.08653   119.93118  -179.83929
   51    49 S   CA   _C4_    44     1.39320   120.10869    -0.13988
   52    51 S   HA   _H15    45     1.08646   119.97964  -179.87333
   53    51 S   CA   _C6_    46     1.39470   120.04919     0.35663
   54    53 S   HA   _H17    47     1.08714   118.87390   179.38008
   55    46 S   CA   _C8_    48     1.39791   121.25000     7.15404
   56    55 S   CO4  _C10    49     1.47839   120.78094     3.77377
   57    56 S   O    _O33    50     1.22652   120.87279  -169.53191
  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  12   5   4   3
  14   2   1   1  15   5  11   5   4   5   2   1   1  10   8   4
   6   3   5   3   4   2   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    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    46    56    39    40    41    42    43    44    45  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    46    47    55    56    57    39    40    41    42    43    44    45  
   35    36  
   36  
    0  
   38    46    47    48    49    53    55    56    39    40    41    42    43    44    45  
   46    47    55    39    42  
   40    41    42    43    44    45    46    53    55    56    57  
   41    42    55    56    57  
   42    55    56    57  
   43    44    45    46    56  
   44    45  
   45  
    0  
   47    48    49    50    51    53    54    55    56    57  
   48    49    50    51    52    53    55    56  
   49    50    51    55  
   50    51    52    53    54    55  
   51    52    53  
   52    53    54    55    56  
   53    54    55  
   54    55    56    57  
   55    56  
   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  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   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   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   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   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   54   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   55   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.470000   1.6780   1.4800   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    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   222.000  1.810
   33    37   317.000  1.522
   33    39   268.000  1.529
   33    42   268.000  1.529
   37    38   570.000  1.229
   37    46   310.000  1.470
   46    47   469.000  1.400
   46    55   469.000  1.400
   47    48   367.000  1.080
   47    49   469.000  1.400
   49    50   367.000  1.080
   49    51   469.000  1.400
   51    52   367.000  1.080
   51    53   469.000  1.400
   53    54   367.000  1.080
   53    55   469.000  1.400
   55    56   310.000  1.470
   56    57   570.000  1.229
   56    39   317.000  1.522
   39    40   340.000  1.090
   39    41   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   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   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    37    75.00000  110.18000
   29    33    39    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    46    65.00000  115.47100
   33    39    56    63.00000  111.10000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    42    43    37.50000  110.70000
   33    42    44    37.50000  110.70000
   33    42    45    37.50000  110.70000
   37    46    47    60.00000  119.52600
   37    46    55    60.00000  119.52600
   46    37    38    75.00000  123.78400
   46    47    48    35.00000  120.00000
   46    47    49    63.00000  120.00000
   46    55    53    63.00000  120.00000
   46    55    56    60.00000  119.52600
   47    49    50    35.00000  120.00000
   47    49    51    63.00000  120.00000
   49    47    48    35.00000  120.00000
   49    51    52    35.00000  120.00000
   49    51    53    63.00000  120.00000
   51    49    50    35.00000  120.00000
   51    53    54    35.00000  120.00000
   51    53    55    63.00000  120.00000
   53    51    52    35.00000  120.00000
   53    55    56    60.00000  119.52600
   55    46    47    63.00000  120.00000
   55    53    54    35.00000  120.00000
   55    56    57    75.00000  123.78400
   55    56    39    65.00000  115.47100
   56    39    40    35.00000  109.50000
   56    39    41    35.00000  109.50000
   39    33    37    63.00000  111.10000
   39    56    57    80.00000  120.40000
   41    39    40    33.00000  107.80000
   42    33    37    63.00000  111.10000
   42    33    39    58.35000  112.70000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    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   0.01700  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    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   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   0.21350  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    37    38   0.30150 -1.0 2.0
   29    33    37    46   0.65300  1.0 1.0
   29    33    37    46  -0.03850 -1.0 2.0
   29    33    37    46   0.33900  1.0 3.0
   29    33    39    56   0.56750  1.0 1.0
   29    33    39    56  -0.07550 -1.0 2.0
   29    33    39    56   0.20000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.15000  1.0 3.0
   29    33    42    45   0.15000  1.0 3.0
   33    37    46    47   2.26350  1.0 1.0
   33    37    46    47   0.76750 -1.0 2.0
   33    37    46    47   0.22500  1.0 3.0
   33    37    46    55   2.26350  1.0 1.0
   33    37    46    55   0.76750 -1.0 2.0
   33    37    46    55   0.22500  1.0 3.0
   37    33    39    56   0.11950  1.0 1.0
   37    33    39    56   0.20300 -1.0 2.0
   37    33    39    56  -0.70800  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    41  -0.11250  1.0 3.0
   37    33    42    43  -0.11250  1.0 3.0
   37    33    42    44  -0.11250  1.0 3.0
   37    33    42    45  -0.11250  1.0 3.0
   37    46    47    48   3.62500 -1.0 2.0
   37    46    47    49   3.62500 -1.0 2.0
   37    46    55    53   3.62500 -1.0 2.0
   37    46   -55    56   3.62500 -1.0 2.0
   38    37    46    47   1.05000 -1.0 2.0
   38    37    46    55   1.05000 -1.0 2.0
   46    47    49    50   3.62500 -1.0 2.0
   46    47    49    51   3.62500 -1.0 2.0
   46    55    56    57   1.05000 -1.0 2.0
   46    55    56    39   2.26350  1.0 1.0
   46    55    56    39   0.76750 -1.0 2.0
   46    55    56    39   0.22500  1.0 3.0
   47    46    55    53   3.62500 -1.0 2.0
   47    46    55    56   3.62500 -1.0 2.0
   47    49    51    52   3.62500 -1.0 2.0
   47    49   -51    53   3.62500 -1.0 2.0
   48    47    49    50   3.62500 -1.0 2.0
   48    47    49    51   3.62500 -1.0 2.0
   49    51    53    54   3.62500 -1.0 2.0
   49    51    53    55   3.62500 -1.0 2.0
   50    49    51    52   3.62500 -1.0 2.0
   50    49    51    53   3.62500 -1.0 2.0
   51    53   -55    46   3.62500 -1.0 2.0
   51    53    55    56   3.62500 -1.0 2.0
   52    51    53    54   3.62500 -1.0 2.0
   52    51    53    55   3.62500 -1.0 2.0
   53    55    56    57   1.05000 -1.0 2.0
   53    55    56    39   2.26350  1.0 1.0
   53    55    56    39   0.76750 -1.0 2.0
   53    55    56    39   0.22500  1.0 3.0
   54    53    55    46   3.62500 -1.0 2.0
   54    53    55    56   3.62500 -1.0 2.0
   55    46    47    48   3.62500 -1.0 2.0
   55    46   -47    49   3.62500 -1.0 2.0
   55    56   -39    33   0.05850 -1.0 2.0
   55    56   -39    33   0.17250  1.0 3.0
   55    56    39    40   0.00000  1.0 1.0
   55    56    39    41   0.00000  1.0 1.0
   57    56    39    33   0.30150 -1.0 2.0
   57    56    39    40   0.00000  1.0 1.0
   57    56    39    41   0.00000  1.0 1.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33   -37    46   0.05850 -1.0 2.0
   39    33   -37    46   0.17250  1.0 3.0
   39    33    42    43   0.15000  1.0 3.0
   39    33    42    44   0.15000  1.0 3.0
   39    33    42    45   0.15000  1.0 3.0
   42    33    37    38   0.30150 -1.0 2.0
   42    33    37    46   0.05850 -1.0 2.0
   42    33    37    46   0.17250  1.0 3.0
   42    33    39    56  -0.95700  1.0 1.0
   42    33    39    56  -0.18200 -1.0 2.0
   42    33    39    56   0.29450  1.0 3.0
   42    33    39    40   0.15000  1.0 3.0
   42    33    39    41   0.15000  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
   33    46    37    38  10.50000 -1.0 2.0
   47    55    46    37   4.00000 -1.0 2.0
   49    48    47    46   1.10000 -1.0 2.0
   51    50    49    47   1.10000 -1.0 2.0
   53    52    51    49   1.10000 -1.0 2.0
   55    54    53    51   1.10000 -1.0 2.0
   53    56    55    46   4.00000 -1.0 2.0
   55    39    56    57  10.50000 -1.0 2.0
END
