* LIGAND DATABASE FILE (OPLS2005)
*
001      57    57     99    155     296
    1     0 S   NP   _N1_     1    27.99401    96.06514   -21.97969
    2     1 S   H    _HN1     2     1.02776    97.11171  -116.58994
    3     1 S   H    _H1_     3     1.02958    80.60892    -9.08757
    4     1 S   H    _H2_     4     1.02835    34.03851   131.78792
    5     1 S   CT   _CA1     5     1.50128   142.04044   102.13693
    6     5 S   HC   _HA1     6     1.09574   105.22164    76.40823
    7     5 S   CO3  _C1_     7     1.53791   112.36299   -43.80047
    8     7 S   O2Z  _O11     8     1.26367   114.99536   -43.84487
    9     7 S   O2Z  _O12     9     1.26235   114.93439   135.26979
   10     5 S   CT   _CB1    10     1.53096   107.42199  -165.66555
   11    10 S   HC   HB11    11     1.09827   109.35351   -50.40560
   12    10 S   HC   HB12    12     1.09816   110.41823    66.15752
   13    10 S   CT   _CG1    13     1.53012   112.66231  -171.47074
   14    13 S   HC   HG11    14     1.09595   110.49298   -64.07911
   15    13 S   HC   HG12    15     1.09656   109.92346    55.12289
   16    13 S   C    _CD1    16     1.51835   112.31817   175.51109
   17    16 S   O    _OE1    17     1.22745   123.29853     0.17017
   18    16 S   N    _N2_    18     1.38555   111.69165  -179.86012
   19    18 S   H    _HN2    19     1.01561   119.00970     4.73772
   20    18 S   CT1  _CA2    20     1.45857   122.90444   178.20115
   21    20 S   HC   _HA2    21     1.09728   108.96986    23.60893
   22    20 S   C    _C2_    22     1.52936   106.96003   -93.45233
   23    22 S   O    _O2_    23     1.22985   123.02218   -26.40514
   24    20 S   CT   _CB2    32     1.53336   112.20557   146.75560
   25    24 S   HC   HB21    33     1.09493   109.59561    54.76158
   26    24 S   HC   HB22    34     1.09386   109.73529   173.57300
   27    22 S   N    _N3_    24     1.38494   112.62069   156.35352
   28    27 S   H    _HN3    25     1.01667   120.36870    -2.16157
   29    24 S   S    _SG2    35     1.82865   110.76143   -65.47789
   30    27 S   CT   _CA3    26     1.45366   122.42131   178.62698
   31    30 S   HC   HA31    27     1.09568   107.83823   -55.23188
   32    30 S   HC   HA32    28     1.09564   107.56917    61.08443
   33    29 S   CT   _C9_    36     1.88328   102.30916  -170.95706
   34    30 S   CO3  _C3_    29     1.52876   114.38173  -177.13297
   35    34 S   O2Z  _O31    30     1.26325   116.06611     1.22381
   36    34 S   O2Z  _O32    31     1.26442   114.40705  -178.84343
   37    33 S   CT   _C4_    37     1.54691   111.37918   -52.46230
   38    37 S   HC   _H4_    38     1.09858   110.49390   177.50888
   39    37 S   HC   _H5_    39     1.09578   111.78700    59.54995
   40    33 S   CM   _C10    51     1.52799   106.50250    65.87471
   41    40 S   HC   _H7_    52     1.09190   114.24165   -96.39877
   42    37 S   CO4  _C5_    40     1.51532   113.00393   -62.86644
   43    42 S   O    _O33    41     1.23015   121.76983   148.64806
   44    40 S   CM   _C11    53     1.34153   131.54714    83.20231
   45    44 S   HC   _H8_    54     1.08944   118.34531   179.89913
   46    42 S   CM   _C6_    42     1.48648   118.29978   -34.65663
   47    44 S   CO3  _C12    55     1.52115   124.64785    -1.37430
   48    47 S   O2Z  _O35    56     1.26430   114.51394    94.39406
   49    47 S   O2Z  _O34    57     1.26193   115.32035   -86.29602
   50    46 S   CM   _C7_    43     1.33763   119.39160     4.33526
   51    50 S   HC   _H6_    44     1.08734   118.92011  -177.54720
   52    46 S   OH   _O37    49     1.37679   118.82588  -174.21314
   53    52 S   HO   _H10    50     0.97435   106.75447    -1.27871
   54    33 S   CT   _C8_    45     1.56139   107.16986  -169.79469
   55    54 S   HC   _H3_    46     1.09600   111.42026   -48.59679
   56    54 S   OH   _O36    47     1.43019   110.94958  -168.89972
   57    56 S   HO   _H9_    48     0.97491   107.26551    83.25468
  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
  17   2   1   1  13   6   5  11   4   7   3   5   3   7   2   1
   1   7   4   2   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    54    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    42    50    54    55    56    40    41    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    42    43    46    50    51    54    55    56    57    40    41    44    45    47  
   35    36  
   36  
    0  
   38    39    42    43    46    50    54    55    56    52    40    41    44  
   39    42    43    46    54    40  
   42    43    46    54    40  
   41    44    45    47    48    49    42    50    54    55    56  
   44    45    47    54  
   43    46    50    51    54    52    53  
   46    50    52  
   45    47    48    49    54  
   47    48    49  
   50    51    54    55    56    52    53  
   48    49  
   49  
    0  
   51    54    55    56    57    52    53  
   54    55    56    52  
   53    54  
    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  -0.335000   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   39   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5500   0.0760  -0.425300   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   47   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   49   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   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   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   54   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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   268.000  1.529
   33    54   268.000  1.529
   33    40   317.000  1.510
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    42   317.000  1.522
   42    43   570.000  1.229
   42    46   320.000  1.462
   46    50   549.000  1.340
   46    52   510.000  1.338
   50    51   340.000  1.080
   50    54   317.000  1.510
   54    55   340.000  1.090
   54    56   320.000  1.410
   56    57   553.000  0.945
   52    53   553.000  0.945
   40    41   340.000  1.080
   40    44   549.000  1.340
   44    45   340.000  1.080
   44    47   230.000  1.545
   47    48   656.000  1.250
   47    49   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    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  111.63000
   29    33    54    75.00000  111.63000
   29    33    40    75.00000  112.20000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    42    63.00000  111.10000
   33    54    50    70.00000  112.02700
   33    54    55    37.50000  110.70000
   33    54    56    50.00000  109.50000
   33    40    41    35.00000  117.00000
   33    40    44    70.00000  124.00000
   37    42    43    80.00000  120.40000
   37    42    46    65.00000  118.62400
   39    37    38    33.00000  107.80000
   42    37    38    35.00000  109.50000
   42    37    39    35.00000  109.50000
   42    46    50    65.00000  118.96000
   42    46    52    85.00000  116.28000
   46    42    43    80.00000  123.72100
   46    50    51    35.00000  120.00000
   46    50    54    70.00000  124.00000
   46    52    53    70.00000  107.45700
   50    54    55    35.00000  109.50000
   50    54    56    90.00000  110.39200
   54    33    37    58.35000  112.70000
   54    50    51    35.00000  117.00000
   54    56    57    55.00000  108.50000
   56    54    55    35.00000  109.50000
   52    46    50    80.00000  121.38400
   40    33    37    70.00000  112.02700
   40    33    54    70.00000  112.02700
   40    44    45    35.00000  120.00000
   40    44    47    55.00000  124.75400
   44    40    41    35.00000  120.00000
   44    47    48    85.00000  113.83300
   44    47    49    85.00000  113.83300
   47    44    45    40.00000  118.53000
   49    47    48    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    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    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   0.21350  1.0 3.0
   24    29    33    40  -0.62250  1.0 1.0
   24    29    33    40  -0.38450 -1.0 2.0
   24    29    33    40   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    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    42   0.56750  1.0 1.0
   29    33    37    42  -0.07550 -1.0 2.0
   29    33    37    42   0.20000  1.0 3.0
   29    33    54    50   0.56750  1.0 1.0
   29    33    54    50  -0.07550 -1.0 2.0
   29    33    54    50   0.20000  1.0 3.0
   29    33    54    55   0.15000  1.0 3.0
   29    33    54    56   0.56750  1.0 1.0
   29    33    54    56  -0.07550 -1.0 2.0
   29    33    54    56   0.20000  1.0 3.0
   29    33    40    41   0.00000  1.0 1.0
   29    33    40    44   0.42700  1.0 1.0
   29    33    40    44  -0.70350 -1.0 2.0
   29    33    40    44  -0.43150  1.0 3.0
   33    37    42    43   0.30150 -1.0 2.0
   33    37    42    46   0.65300  1.0 1.0
   33    37    42    46  -0.03850 -1.0 2.0
   33    37    42    46   0.33900  1.0 3.0
   33    54    56    57  -0.11600  1.0 1.0
   33    54    56    57  -0.09450 -1.0 2.0
   33    54    56    57   0.21250  1.0 3.0
   33    40    44    45   7.00000 -1.0 2.0
   33    40    44    47   7.00000 -1.0 2.0
   37    33    54    50   0.34400  1.0 1.0
   37    33    54    50   0.09450 -1.0 2.0
   37    33    54    50   0.11100  1.0 3.0
   37    33    54    55   0.15000  1.0 3.0
   37    33    54    56   0.86500  1.0 1.0
   37    33    54    56  -0.17500 -1.0 2.0
   37    33    54    56   0.20800  1.0 3.0
   37    33    40    41   0.00000  1.0 1.0
   37    33    40    44   0.09850  1.0 1.0
   37    33    40    44   0.15250 -1.0 2.0
   37    33    40    44  -0.50650  1.0 3.0
   37    42   -46    50  -0.33500  1.0 1.0
   37    42   -46    50   1.06600 -1.0 2.0
   37    42   -46    50  -0.14000  1.0 3.0
   37    42    46    52   0.32450 -1.0 2.0
   37    42    46    52   0.17400  1.0 3.0
   38    37    42    43   0.00000  1.0 1.0
   38    37    42    46   0.00000  1.0 1.0
   39    37    42    43   0.00000  1.0 1.0
   39    37    42    46   0.00000  1.0 1.0
   42    46    50    51   7.00000 -1.0 2.0
   42    46    50    54   7.00000 -1.0 2.0
   42    46    52    53   2.00000 -1.0 2.0
   43    42    46    50   1.00000 -1.0 2.0
   43    42    46    52  -0.11900  1.0 1.0
   43    42    46    52   0.76850 -1.0 2.0
   43    42    46    52   0.14100  1.0 3.0
   46    50   -54    33   0.09850  1.0 1.0
   46    50   -54    33   0.15250 -1.0 2.0
   46    50   -54    33  -0.50650  1.0 3.0
   46    50    54    55   0.00000  1.0 1.0
   46    50    54    56   0.67800  1.0 1.0
   46    50    54    56   0.47050 -1.0 2.0
   46    50    54    56  -0.62500  1.0 3.0
   50    46    52    53  -0.66100  1.0 1.0
   50    46    52    53   1.20850 -1.0 2.0
   50    46    52    53  -0.36000  1.0 3.0
   50    54    56    57  -0.07800  1.0 1.0
   50    54    56    57  -0.21500 -1.0 2.0
   50    54    56    57  -0.03150  1.0 3.0
   51    50    54    33   0.00000  1.0 1.0
   51    50    54    55   0.33100  1.0 3.0
   51    50    54    56   0.00000  1.0 1.0
   54    33    37    38   0.15000  1.0 3.0
   54    33    37    39   0.15000  1.0 3.0
   54    33   -37    42  -0.95700  1.0 1.0
   54    33   -37    42  -0.18200 -1.0 2.0
   54    33   -37    42   0.29450  1.0 3.0
   54    33    40    41   0.00000  1.0 1.0
   54    33    40    44   0.09850  1.0 1.0
   54    33    40    44   0.15250 -1.0 2.0
   54    33    40    44  -0.50650  1.0 3.0
   55    54    56    57   0.19450  1.0 3.0
   52    46    50    51   7.00000 -1.0 2.0
   52    46    50    54   7.00000 -1.0 2.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    42  -0.98800  1.0 1.0
   40    33    37    42   0.48800 -1.0 2.0
   40    33    37    42   0.76800  1.0 3.0
   40    33    54    50   0.31000  1.0 1.0
   40    33    54    50   0.14700 -1.0 2.0
   40    33    54    50   0.07550  1.0 3.0
   40    33    54    55   0.15000  1.0 3.0
   40    33    54    56   1.05650  1.0 1.0
   40    33    54    56   0.15600 -1.0 2.0
   40    33    54    56   0.53150  1.0 3.0
   40    44    47    48  -0.04000 -1.0 2.0
   40    44    47    48  -0.29050  1.0 3.0
   40    44    47    49  -0.04000 -1.0 2.0
   40    44    47    49  -0.29050  1.0 3.0
   41    40    44    45   7.00000 -1.0 2.0
   41    40    44    47   7.00000 -1.0 2.0
   45    44    47    48   0.00000  1.0 1.0
   45    44    47    49   0.00000  1.0 1.0
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
   37    46    42    43  10.50000 -1.0 2.0
   42    52    46    50   1.10000 -1.0 2.0
   54    51    50    46   1.10000 -1.0 2.0
   33    41    40    44  15.00000 -1.0 2.0
   47    45    44    40  15.00000 -1.0 2.0
   48    44    47    49  10.50000 -1.0 2.0
END
