* LIGAND DATABASE FILE (OPLS2005)
*
001      65    66    117    177     340
    1     0 S   NP   _N1_     1    28.69711    95.92465   -22.84293
    2     1 S   H    _HN1     2     1.02950    76.11666    16.72854
    3     1 S   H    _H1_     3     1.02829    36.58517   163.93572
    4     1 S   H    _H2_     4     1.02783   100.26765   -89.82270
    5     1 S   CT   _CA1     5     1.50108   141.66689   122.18077
    6     5 S   HC   _HA1     6     1.09573   105.21248    84.34333
    7     5 S   CO3  _C1_     7     1.53793   112.43591   -35.90956
    8     7 S   O2Z  _O11     8     1.26370   115.00913   -43.19198
    9     7 S   O2Z  _O12     9     1.26239   114.94554   135.96956
   10     5 S   CT   _CB1    10     1.53085   107.42596  -157.67825
   11    10 S   HC   HB11    11     1.09830   109.39072   -49.92409
   12    10 S   HC   HB12    12     1.09814   110.43634    66.68283
   13    10 S   CT   _CG1    13     1.52985   112.59773  -170.91983
   14    13 S   HC   HG11    14     1.09585   110.59143   -64.83636
   15    13 S   HC   HG12    15     1.09668   109.82832    54.38983
   16    13 S   C    _CD1    16     1.51798   112.27630   174.83737
   17    16 S   O    _OE1    17     1.22727   123.30900     4.80204
   18    16 S   N    _N2_    18     1.38655   111.63456  -175.27644
   19    18 S   H    _HN2    19     1.01582   118.94660     1.83686
   20    18 S   CT1  _CA2    20     1.46195   123.39366   177.94948
   21    20 S   HC   _HA2    21     1.09742   109.36392     1.27042
   22    20 S   C    _C2_    22     1.53549   108.62781  -114.17216
   23    22 S   O    _O2_    23     1.23056   122.29198  -148.38746
   24    20 S   CT   _CB2    32     1.53461   111.61811   123.24849
   25    24 S   HC   HB21    33     1.09458   109.64932    56.07346
   26    24 S   HC   HB22    34     1.09384   109.74492   174.84064
   27    22 S   N    _N3_    24     1.38331   113.69746    39.09739
   28    27 S   H    _HN3    25     1.01592   119.57887    -3.41650
   29    24 S   S    _SG2    35     1.83056   111.15911   -64.68670
   30    27 S   CT   _CA3    26     1.45287   123.18808   177.07504
   31    30 S   HC   HA31    27     1.09550   107.51529   -64.37298
   32    30 S   HC   HA32    28     1.09557   107.97412    52.05765
   33    29 S   CT   _C5_    36     1.87019   101.35328  -169.25671
   34    30 S   CO3  _C3_    29     1.52952   114.09650   174.05202
   35    34 S   O2Z  _O31    30     1.26375   116.06643    -0.63211
   36    34 S   O2Z  _O32    31     1.26430   114.41093   179.42768
   37    33 S   CT   _C6_    37     1.55619   108.87436   173.06381
   38    37 S   HC   _H3_    38     1.09791   108.89870    47.61495
   39    33 S   CT   _C4_    62     1.54141   105.86604   -68.78535
   40    39 S   HC   _H4_    63     1.09504   111.96975    63.02516
   41    39 S   HC   _H5_    64     1.09569   112.19701   -59.75705
   42    39 S   HC   _H6_    65     1.09503   111.51909   179.26805
   43    37 S   S    _S1_    39     1.83927   112.44796   -71.00407
   44    37 S   C    _C9_    47     1.54058   114.45738   167.99914
   45    44 S   O    _O34    48     1.22779   121.98918    32.71083
   46    43 S   CT   _C7_    40     1.81266    98.03850   -49.95546
   47    46 S   HC   _H7_    41     1.09375   108.89014   -69.66820
   48    46 S   HC   _H8_    42     1.09423   108.49772   173.34857
   49    44 S   N    _N4_    49     1.39336   111.60852  -148.69376
   50    49 S   H    _H11    50     1.01684   117.28346    -2.13561
   51    46 S   CT   _C8_    43     1.51794   110.49616    52.50474
   52    51 S   HC   _H9_    44     1.09549   111.75055    63.50092
   53    51 S   HC   _H10    45     1.09580   108.32014   179.72660
   54    49 S   CA   _C10    51     1.41468   127.54271   179.15304
   55    33 S   OS   _O33    46     1.43706   113.24338    47.39732
   56    54 S   CA   _C11    52     1.40304   116.85293   178.41588
   57    56 S   HA   _H12    53     1.08778   120.65810    -0.12972
   58    56 S   CA   _C12    54     1.39649   120.78446   179.94405
   59    58 S   HA   _H13    55     1.08625   119.97915   179.93744
   60    58 S   CA   _C13    56     1.39146   119.97693    -0.06256
   61    60 S   HA   _H14    57     1.08601   120.15484  -180.00000
   62    60 S   CA   _C14    58     1.39275   119.73068    -0.02798
   63    62 S   HA   _H15    59     1.08669   119.85353  -179.90513
   64    54 S   CA   _C15    60     1.39798   124.37561    -1.80428
   65    64 S   HA   _H16    61     1.08380   122.35130    -0.13270
  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  11   5   4   3
  15   2   1   1  16   7   7   3   2   1  10   8   3   6   5   4
   8   3   3   2   1   9   1   8   4   6   3   5   3   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    55    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    51    55    44    39    40    41    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    43    46    51    52    53    55    44    45    49    39    40    41    42  
   35    36  
   36  
    0  
   38    43    46    47    48    51    55    44    45    49    50    54    39    40    41    42  
   43    46    55    44    45    49    39  
   40    41    42    43    44    51    55  
   41    42    55  
   42    55  
   55  
   46    47    48    51    52    53    55    44    45    49  
   45    49    50    54    56    64    46    55  
   49    50    54  
   47    48    51    52    53    55  
   48    51    52    53    55  
   51    52    53    55  
   50    54    56    57    58    62    64    65  
   54    56    64  
   52    53    55  
   53    55  
   55  
   56    57    58    59    60    62    63    64    65  
    0  
   57    58    59    60    61    62    64    65  
   58    59    60    64  
   59    60    61    62    63    64  
   60    61    62  
   61    62    63    64    65  
   62    63    64  
   63    64    65  
   64    65  
   65  
    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  -0.316400   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   0.348900   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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   44   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   46   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   50   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   51   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   55   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   56   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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   222.000  1.810
   33    37   268.000  1.529
   33    55   320.000  1.410
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    43   222.000  1.810
   37    44   317.000  1.522
   43    46   222.000  1.810
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    55   320.000  1.410
   44    45   570.000  1.229
   44    49   490.000  1.335
   49    50   434.000  1.010
   49    54   360.000  1.404
   54    56   469.000  1.400
   54    64   469.000  1.400
   56    57   367.000  1.080
   56    58   469.000  1.400
   58    59   367.000  1.080
   58    60   469.000  1.400
   60    61   367.000  1.080
   60    62   469.000  1.400
   62    63   367.000  1.080
   62    64   469.000  1.400
   64    65   367.000  1.080
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   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  111.63000
   29    33    55    85.00000  114.68000
   29    33    39    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    43    75.00000  111.63000
   33    37    44    63.00000  111.10000
   33    55    51    60.00000  109.50000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   37    43    46    62.00000   98.90000
   37    44    45    80.00000  120.40000
   37    44    49    70.00000  116.60000
   43    37    38    35.00000  109.50000
   43    46    47    35.00000  109.50000
   43    46    48    35.00000  109.50000
   43    46    51    75.00000  111.63000
   46    51    52    37.50000  110.70000
   46    51    53    37.50000  110.70000
   46    51    55    50.00000  109.50000
   48    46    47    33.00000  107.80000
   51    46    47    37.50000  110.70000
   51    46    48    37.50000  110.70000
   53    51    52    33.00000  107.80000
   55    33    37    50.00000  109.50000
   55    51    52    35.00000  109.50000
   55    51    53    35.00000  109.50000
   44    37    38    35.00000  109.50000
   44    37    43    70.00000  112.33000
   44    49    50    35.00000  119.80000
   44    49    54    65.00000  121.96500
   49    44    45    80.00000  122.90000
   49    54    56    70.00000  119.01900
   49    54    64    70.00000  119.01900
   54    49    50    45.00000  118.23600
   54    56    57    35.00000  120.00000
   54    56    58    63.00000  120.00000
   54    64    62    63.00000  120.00000
   54    64    65    35.00000  120.00000
   56    58    59    35.00000  120.00000
   56    58    60    63.00000  120.00000
   58    56    57    35.00000  120.00000
   58    60    61    35.00000  120.00000
   58    60    62    63.00000  120.00000
   60    58    59    35.00000  120.00000
   60    62    63    35.00000  120.00000
   60    62    64    63.00000  120.00000
   62    60    61    35.00000  120.00000
   62    64    65    35.00000  120.00000
   64    54    56    63.00000  120.00000
   64    62    63    35.00000  120.00000
   39    33    37    58.35000  112.70000
   39    33    55    50.00000  109.50000
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    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    55   0.13850  1.0 1.0
   24    29    33    55  -1.34450 -1.0 2.0
   24    29    33    55   0.57400  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
   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    43   0.56750  1.0 1.0
   29    33    37    43  -0.07550 -1.0 2.0
   29    33    37    43   0.20000  1.0 3.0
   29    33    37    44   0.56750  1.0 1.0
   29    33    37    44  -0.07550 -1.0 2.0
   29    33    37    44   0.20000  1.0 3.0
   29    33    55    51   0.14700  1.0 1.0
   29    33    55    51  -1.16150 -1.0 2.0
   29    33    55    51   0.48700  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    39    42   0.15000  1.0 3.0
   33    37    43    46   0.01700  1.0 1.0
   33    37    43    46  -0.23550 -1.0 2.0
   33    37    43    46   0.21350  1.0 3.0
   33    37    44    45   0.30150 -1.0 2.0
   33    37    44    49   1.39750  1.0 1.0
   33    37    44    49  -0.07950 -1.0 2.0
   33    37    44    49  -0.18750  1.0 3.0
   37    33    55    51   0.06250  1.0 1.0
   37    33    55    51  -0.01100 -1.0 2.0
   37    33    55    51   0.28050  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    42   0.15000  1.0 3.0
   37    43    46    47   0.32350  1.0 3.0
   37    43    46    48   0.32350  1.0 3.0
   37    43   -46    51   0.01700  1.0 1.0
   37    43   -46    51  -0.23550 -1.0 2.0
   37    43   -46    51   0.21350  1.0 3.0
   37    44    49    50   2.45000 -1.0 2.0
   37    44    49    54   0.76000  1.0 1.0
   37    44    49    54   4.11600 -1.0 2.0
   38    37    43    46   0.32350  1.0 3.0
   38    37    44    45   0.00000  1.0 1.0
   38    37    44    49   0.00000  1.0 1.0
   43    37    44    45   0.30150 -1.0 2.0
   43    37    44    49   0.00000  1.0 1.0
   43    46    51    52   0.15000  1.0 3.0
   43    46    51    53   0.15000  1.0 3.0
   43    46    51    55   0.56750  1.0 1.0
   43    46    51    55  -0.07550 -1.0 2.0
   43    46    51    55   0.20000  1.0 3.0
   46    51   -55    33   0.06250  1.0 1.0
   46    51   -55    33  -0.01100 -1.0 2.0
   46    51   -55    33   0.28050  1.0 3.0
   47    46    51    52   0.15000  1.0 3.0
   47    46    51    53   0.15000  1.0 3.0
   47    46    51    55   0.23400  1.0 3.0
   48    46    51    52   0.15000  1.0 3.0
   48    46    51    53   0.15000  1.0 3.0
   48    46    51    55   0.23400  1.0 3.0
   52    51    55    33   0.37050  1.0 3.0
   53    51    55    33   0.37050  1.0 3.0
   55    33    37    38   0.23400  1.0 3.0
   55    33   -37    43   0.56750  1.0 1.0
   55    33   -37    43  -0.07550 -1.0 2.0
   55    33   -37    43   0.20000  1.0 3.0
   55    33    37    44  -0.09450  1.0 1.0
   55    33    37    44  -1.12950 -1.0 2.0
   55    33    37    44   0.54000  1.0 3.0
   55    33    39    40   0.23400  1.0 3.0
   55    33    39    41   0.23400  1.0 3.0
   55    33    39    42   0.23400  1.0 3.0
   44    37    43    46   0.01700  1.0 1.0
   44    37    43    46  -0.23550 -1.0 2.0
   44    37    43    46   0.21350  1.0 3.0
   44    49    54    56   1.00100  1.0 1.0
   44    49    54    56   0.85050 -1.0 2.0
   44    49    54    64   1.00100  1.0 1.0
   44    49    54    64   0.85050 -1.0 2.0
   45    44    49    50   2.45000 -1.0 2.0
   45    44    49    54   0.04000 -1.0 2.0
   49    54    56    57   3.62500 -1.0 2.0
   49    54    56    58   3.62500 -1.0 2.0
   49    54    64    62   3.62500 -1.0 2.0
   49    54    64    65   3.62500 -1.0 2.0
   50    49    54    56   0.97800 -1.0 2.0
   50    49    54    64   0.97800 -1.0 2.0
   54    56    58    59   3.62500 -1.0 2.0
   54    56    58    60   3.62500 -1.0 2.0
   56    54    64    62   3.62500 -1.0 2.0
   56    54    64    65   3.62500 -1.0 2.0
   56    58    60    61   3.62500 -1.0 2.0
   56    58   -60    62   3.62500 -1.0 2.0
   57    56    58    59   3.62500 -1.0 2.0
   57    56    58    60   3.62500 -1.0 2.0
   58    60    62    63   3.62500 -1.0 2.0
   58    60    62    64   3.62500 -1.0 2.0
   59    58    60    61   3.62500 -1.0 2.0
   59    58    60    62   3.62500 -1.0 2.0
   60    62   -64    54   3.62500 -1.0 2.0
   60    62    64    65   3.62500 -1.0 2.0
   61    60    62    63   3.62500 -1.0 2.0
   61    60    62    64   3.62500 -1.0 2.0
   63    62    64    54   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   64    54    56    57   3.62500 -1.0 2.0
   64    54   -56    58   3.62500 -1.0 2.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    43   0.44750  1.0 1.0
   39    33    37    43  -0.17800 -1.0 2.0
   39    33    37    43   0.20200  1.0 3.0
   39    33    37    44  -0.95700  1.0 1.0
   39    33    37    44  -0.18200 -1.0 2.0
   39    33    37    44   0.29450  1.0 3.0
   39    33    55    51   0.06250  1.0 1.0
   39    33    55    51  -0.01100 -1.0 2.0
   39    33    55    51   0.28050  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
   37    49    44    45  10.50000 -1.0 2.0
   50    44    49    54   1.00000 -1.0 2.0
   56    64    54    49   4.00000 -1.0 2.0
   58    57    56    54   1.10000 -1.0 2.0
   60    59    58    56   1.10000 -1.0 2.0
   62    61    60    58   1.10000 -1.0 2.0
   64    63    62    60   1.10000 -1.0 2.0
   62    65    64    54   1.10000 -1.0 2.0
END
