* LIGAND DATABASE FILE (OPLS2005)
*
001      57    58    101    161     299
    1     0 S   NP   _N1_     1    28.71697    95.95739   -23.13137
    2     1 S   H    _HN1     2     1.02783   102.52018   -88.59102
    3     1 S   H    _H1_     3     1.02951    75.25408    17.38089
    4     1 S   H    _H2_     4     1.02829    36.23997   168.15146
    5     1 S   CT   _CA1     5     1.50107   139.85660   121.68650
    6     5 S   HC   _HA1     6     1.09573   105.21168    86.47944
    7     5 S   CO3  _C1_     7     1.53798   112.45549   -33.76991
    8     7 S   O2Z  _O11     8     1.26370   115.00917   -42.70226
    9     7 S   O2Z  _O12     9     1.26242   114.94962   136.48112
   10     5 S   CT   _CB1    10     1.53089   107.42847  -155.53359
   11    10 S   HC   HB11    11     1.09829   109.39659   -49.88540
   12    10 S   HC   HB12    12     1.09814   110.43276    66.72859
   13    10 S   CT   _CG1    13     1.52979   112.58953  -170.88559
   14    13 S   HC   HG11    14     1.09588   110.57735   -64.77075
   15    13 S   HC   HG12    15     1.09668   109.83505    54.44871
   16    13 S   C    _CD1    16     1.51797   112.31341   174.90000
   17    16 S   O    _OE1    17     1.22720   123.32095     4.25054
   18    16 S   N    _N2_    18     1.38648   111.59563  -175.81151
   19    18 S   H    _HN2    19     1.01580   118.91171     2.01120
   20    18 S   CT1  _CA2    20     1.46201   123.44073   178.22073
   21    20 S   HC   _HA2    21     1.09734   109.40517     0.86931
   22    20 S   C    _C2_    22     1.53505   108.54631  -114.65449
   23    22 S   O    _O2_    23     1.23049   122.30677  -147.55755
   24    20 S   CT   _CB2    32     1.53298   111.44848   122.90653
   25    24 S   HC   HB21    33     1.09516   110.02747    56.11389
   26    24 S   HC   HB22    34     1.09526   110.28900   175.11637
   27    22 S   N    _N3_    24     1.38340   113.65557    39.86924
   28    27 S   H    _HN3    25     1.01596   119.57079    -3.38848
   29    24 S   S    _SG2    35     1.82749   111.48776   -65.36000
   30    27 S   CT   _CA3    26     1.45289   123.18397   177.07638
   31    30 S   HC   HA31    27     1.09550   107.50643   -64.45927
   32    30 S   HC   HA32    28     1.09557   107.98310    51.97080
   33    29 S   CT   _C10    36     1.84890    99.29092   175.99405
   34    33 S   HC   _H3_    37     1.09526   108.23187    35.28009
   35    30 S   CO3  _C3_    29     1.52953   114.09635   173.95941
   36    35 S   O2Z  _O31    30     1.26374   116.06095    -1.10588
   37    35 S   O2Z  _O32    31     1.26429   114.41390   178.96203
   38    33 S   CA   _C7_    38     1.52323   108.76888   153.41957
   39    38 S   CA   _C6_    39     1.41149   119.43110    94.90264
   40    39 S   CA   _C5_    40     1.40492   120.27110  -176.28691
   41    40 S   HA   _H6_    41     1.08809   120.54691   179.80218
   42    39 S   CM   _C13    50     1.46631   120.66257     3.71394
   43    42 S   HC   _H9_    51     1.08483   118.88500  -170.05731
   44    40 S   CA   _C4_    42     1.39610   120.77522    -0.52563
   45    44 S   HA   _H5_    43     1.08644   119.89858  -179.81869
   46    42 S   CM   _C12    52     1.33844   120.49718    12.77614
   47    46 S   HC   _H8_    53     1.08614   119.41176   177.18527
   48    44 S   CA   _C9_    44     1.39015   120.04928     0.07913
   49    48 S   HA   _H7_    45     1.08666   119.64769  -179.90309
   50    33 S   CT   _C11    54     1.54823   110.05591   -82.59684
   51    50 S   HC   _H4_    55     1.09563   110.54232    37.32739
   52    38 S   CA   _C8_    46     1.40723   123.25106   -81.81974
   53    50 S   OH   _O35    56     1.43136   108.49249   152.93260
   54    53 S   HO   _H10    57     0.97259   107.76514   178.62769
   55    52 S   NO2  _N4_    47     1.44386   120.69077    -3.37429
   56    55 S   ON   _O34    48     1.23737   116.94629   -76.80350
   57    55 S   ON   _O33    49     1.23730   116.96052   104.09048
  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   9   5   4   3
  14   7   2   1   1  16  12   9   4   8   3   5   3   5   3   5
   2   4   2   3   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    52    46    50    51    53  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    48    52    55    42    46    47    50    51    53    54  
   38    39    52    46    50    51    53  
   36    37  
   37  
    0  
   39    40    41    44    48    49    52    55    56    57    42    43    46    50    51    53  
   40    41    44    45    48    52    55    42    43    46    47    50  
   41    44    45    48    49    52    42    43    46  
   44    45    48    42  
   43    46    47    50    51    53    44    52  
   46    47    50  
   45    48    49    52    55  
   48    49    52  
   47    50    51    53    54  
   50    51    53  
   49    52    55    56    57  
   52    55  
   51    53    54    52  
   53    54  
   55    56    57  
   54  
    0  
   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   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   45   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   46   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   56   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   57   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    50   268.000  1.529
   38    39   469.000  1.400
   38    52   469.000  1.400
   39    40   469.000  1.400
   39    42   320.000  1.460
   40    41   367.000  1.080
   40    44   469.000  1.400
   44    45   367.000  1.080
   44    48   469.000  1.400
   48    49   367.000  1.080
   48    52   469.000  1.400
   52    55   400.000  1.460
   55    56   550.000  1.225
   55    57   550.000  1.225
   42    43   340.000  1.080
   42    46   549.000  1.340
   46    47   340.000  1.080
   46    50   317.000  1.510
   50    51   340.000  1.090
   50    53   320.000  1.410
   53    54   553.000  0.945
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    50    75.00000  111.63000
   33    38    39    70.00000  120.00000
   33    38    52    70.00000  120.00000
   33    50    46    70.00000  112.02700
   33    50    51    37.50000  110.70000
   33    50    53    50.00000  109.50000
   38    33    34    35.00000  109.50000
   38    39    40    63.00000  120.00000
   38    39    42    60.00000  120.93500
   38    52    48    63.00000  120.00000
   38    52    55    85.00000  120.00000
   39    40    41    35.00000  120.00000
   39    40    44    63.00000  120.00000
   39    42    43    40.00000  117.26300
   39    42    46    60.00000  123.20500
   40    44    45    35.00000  120.00000
   40    44    48    63.00000  120.00000
   44    40    41    35.00000  120.00000
   44    48    49    35.00000  120.00000
   44    48    52    63.00000  120.00000
   48    44    45    35.00000  120.00000
   48    52    55    85.00000  120.00000
   52    38    39    63.00000  120.00000
   52    48    49    35.00000  120.00000
   52    55    56    80.00000  117.50000
   52    55    57    80.00000  117.50000
   57    55    56    80.00000  125.30000
   42    39    40    60.00000  120.93500
   42    46    47    35.00000  120.00000
   42    46    50    70.00000  124.00000
   46    42    43    35.00000  120.00000
   46    50    51    35.00000  109.50000
   46    50    53    90.00000  110.39200
   50    33    34    37.50000  110.70000
   50    33    38    70.00000  112.17500
   50    46    47    35.00000  117.00000
   50    53    54    55.00000  108.50000
   53    50    51    35.00000  109.50000
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   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    38    39  -0.16000  1.0 1.0
   29    33    38    39  -0.03200 -1.0 2.0
   29    33    38    39   0.04500  1.0 3.0
   29    33    38    52  -0.16000  1.0 1.0
   29    33    38    52  -0.03200 -1.0 2.0
   29    33    38    52   0.04500  1.0 3.0
   29    33    50    46   0.56750  1.0 1.0
   29    33    50    46  -0.07550 -1.0 2.0
   29    33    50    46   0.20000  1.0 3.0
   29    33    50    51   0.15000  1.0 3.0
   29    33    50    53   0.56750  1.0 1.0
   29    33    50    53  -0.07550 -1.0 2.0
   29    33    50    53   0.20000  1.0 3.0
   33    38    39    40   3.62500 -1.0 2.0
   33    38    39    42   3.62500 -1.0 2.0
   33    38    52    48   3.62500 -1.0 2.0
   33    38    52    55   3.62500 -1.0 2.0
   33    50    53    54  -0.11600  1.0 1.0
   33    50    53    54  -0.09450 -1.0 2.0
   33    50    53    54   0.21250  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    52   0.00000  1.0 1.0
   34    33    50    46   0.15000  1.0 3.0
   34    33    50    51   0.15000  1.0 3.0
   34    33    50    53   0.23400  1.0 3.0
   38    33    50    46   0.21200  1.0 1.0
   38    33    50    46   0.16900 -1.0 2.0
   38    33    50    46  -1.15100  1.0 3.0
   38    33    50    51   0.43200  1.0 3.0
   38    33    50    53   1.13150  1.0 1.0
   38    33    50    53  -1.01400 -1.0 2.0
   38    39    40    41   3.62500 -1.0 2.0
   38    39    40    44   3.62500 -1.0 2.0
   38    39    42    43   0.56550  1.0 3.0
   38    39   -42    46   0.15800  1.0 1.0
   38    39   -42    46   1.85350 -1.0 2.0
   38    39   -42    46  -0.48700  1.0 3.0
   38    52    55    56   0.69950 -1.0 2.0
   38    52    55    57   0.69950 -1.0 2.0
   39    38    52    48   3.62500 -1.0 2.0
   39    38    52    55   3.62500 -1.0 2.0
   39    40    44    45   3.62500 -1.0 2.0
   39    40   -44    48   3.62500 -1.0 2.0
   39    42    46    47   7.00000 -1.0 2.0
   39    42    46    50   7.00000 -1.0 2.0
   40    39    42    43   0.56550  1.0 3.0
   40    39    42    46   0.15800  1.0 1.0
   40    39    42    46   1.85350 -1.0 2.0
   40    39    42    46  -0.48700  1.0 3.0
   40    44    48    49   3.62500 -1.0 2.0
   40    44    48    52   3.62500 -1.0 2.0
   41    40    44    45   3.62500 -1.0 2.0
   41    40    44    48   3.62500 -1.0 2.0
   44    48   -52    38   3.62500 -1.0 2.0
   44    48    52    55   3.62500 -1.0 2.0
   45    44    48    49   3.62500 -1.0 2.0
   45    44    48    52   3.62500 -1.0 2.0
   48    52    55    56   0.69950 -1.0 2.0
   48    52    55    57   0.69950 -1.0 2.0
   49    48    52    38   3.62500 -1.0 2.0
   49    48    52    55   3.62500 -1.0 2.0
   52    38   -39    40   3.62500 -1.0 2.0
   52    38    39    42   3.62500 -1.0 2.0
   42    39    40    41   3.62500 -1.0 2.0
   42    39    40    44   3.62500 -1.0 2.0
   42    46   -50    33   0.09850  1.0 1.0
   42    46   -50    33   0.15250 -1.0 2.0
   42    46   -50    33  -0.50650  1.0 3.0
   42    46    50    51   0.00000  1.0 1.0
   42    46    50    53   0.67800  1.0 1.0
   42    46    50    53   0.47050 -1.0 2.0
   42    46    50    53  -0.62500  1.0 3.0
   43    42    46    47   7.00000 -1.0 2.0
   43    42    46    50   7.00000 -1.0 2.0
   46    50    53    54  -0.07800  1.0 1.0
   46    50    53    54  -0.21500 -1.0 2.0
   46    50    53    54  -0.03150  1.0 3.0
   47    46    50    33   0.00000  1.0 1.0
   47    46    50    51   0.33100  1.0 3.0
   47    46    50    53   0.00000  1.0 1.0
   50    33   -38    39   0.04150 -1.0 2.0
   50    33    38    52   0.04150 -1.0 2.0
   51    50    53    54   0.19450  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
   36    30    35    37  10.50000 -1.0 2.0
   39    52    38    33   4.00000 -1.0 2.0
   40    42    39    38   4.00000 -1.0 2.0
   44    41    40    39   1.10000 -1.0 2.0
   48    45    44    40   1.10000 -1.0 2.0
   52    49    48    44   1.10000 -1.0 2.0
   48    55    52    38   4.00000 -1.0 2.0
   56    52    55    57  10.50000 -1.0 2.0
   39    43    42    46   1.10000 -1.0 2.0
   50    47    46    42   1.10000 -1.0 2.0
END
