* LIGAND DATABASE FILE (OPLS2005)
*
001      71    72    125    186     358
    1     0 S   NP   _N1_     1    29.20402    98.82518   -20.90442
    2     1 S   H    _HN1     2     1.02946    59.19473    -0.11869
    3     1 S   H    _H1_     3     1.02828    54.97039   146.53371
    4     1 S   H    _H2_     4     1.02794    97.67415  -106.97711
    5     1 S   CT   _CA1     5     1.50117   150.08123    77.11901
    6     5 S   HC   _HA1     6     1.09567   105.18559   114.28818
    7     5 S   CO3  _C1_     7     1.53818   112.46795    -5.98085
    8     7 S   O2Z  _O11     8     1.26391   115.01248   -41.39495
    9     7 S   O2Z  _O12     9     1.26226   114.98699   137.76419
   10     5 S   CT   _CB1    10     1.53075   107.41706  -127.63757
   11    10 S   HC   HB11    11     1.09838   109.51683   -48.35530
   12    10 S   HC   HB12    12     1.09789   110.39669    68.22883
   13    10 S   CT   _CG1    13     1.52981   112.56913  -169.17638
   14    13 S   HC   HG11    14     1.09522   110.85997   -64.05128
   15    13 S   HC   HG12    15     1.09672   109.62512    55.05881
   16    13 S   C    _CD1    16     1.51805   112.13107   175.59513
   17    16 S   O    _OE1    17     1.22727   123.28488    10.88484
   18    16 S   N    _N2_    18     1.38605   111.67967  -169.22771
   19    18 S   H    _HN2    19     1.01599   118.78764     0.53045
   20    18 S   CT1  _CA2    20     1.45949   123.63464   176.83306
   21    20 S   HC   _HA2    21     1.09733   109.29313     5.79407
   22    20 S   C    _C2_    22     1.53684   108.53595  -109.54535
   23    22 S   O    _O2_    23     1.23071   122.26765  -147.84582
   24    20 S   CT   _CB2    32     1.53333   111.92296   127.93869
   25    24 S   HC   HB21    33     1.09546   111.11033    57.49102
   26    24 S   HC   HB22    34     1.09569   109.68851   175.09464
   27    22 S   N    _N3_    24     1.38320   113.81632    39.59242
   28    27 S   H    _HN3    25     1.01557   119.62660    -3.17003
   29    24 S   S    _SG2    35     1.82717   112.70182   -67.02003
   30    27 S   CT   _CA3    26     1.45288   123.26711   177.25149
   31    30 S   HC   HA31    27     1.09547   107.49554   -65.11715
   32    30 S   HC   HA32    28     1.09555   108.01658    51.34461
   33    29 S   CT   _C18    36     1.83559   100.02361   103.42781
   34    33 S   F    F1__    37     1.36652   108.67509   -57.20203
   35    33 S   F    F2__    38     1.36661   108.73511    54.43613
   36    30 S   CO3  _C3_    29     1.52973   114.03797   173.34115
   37    36 S   O2Z  _O31    30     1.26383   116.06572    -0.97076
   38    36 S   O2Z  _O32    31     1.26424   114.42250   179.09151
   39    33 S   CA   _C17    39     1.53057   110.22080   178.61803
   40    39 S   CA   _C12    40     1.43838   121.53599   -87.79372
   41    39 S   CA   _C16    53     1.41718   118.67877    91.30386
   42    40 S   CA   _C11    41     1.41951   123.84577     3.92191
   43    42 S   HA   _H10    42     1.08646   121.28628     1.83483
   44    41 S   OS   _O35    54     1.37279   116.81639    -3.52898
   45    42 S   CA   _C10    43     1.39696   122.88034  -179.32740
   46    45 S   HA   _H9_    44     1.08627   119.96332  -179.86878
   47    44 S   CT   _C19    55     1.42261   117.79086  -173.02012
   48    47 S   HC   _H13    56     1.09304   107.71709   174.13195
   49    47 S   HC   _H14    57     1.09506   111.40509    56.63270
   50    47 S   HC   _H15    58     1.09462   110.93142   -68.10785
   51    45 S   CA   _C9_    45     1.38243   119.92795    -0.18871
   52    51 S   HA   _H8_    46     1.08672   119.68334  -179.67615
   53    51 S   CA   _C8_    47     1.39729   119.17637    -0.76566
   54    40 S   CA   _C13    48     1.42203   119.31804  -176.87519
   55    53 S   CDS  _C7_    59     1.49118   116.53781  -179.78694
   56    55 S   SD   _S1_    60     1.69603   117.31921   -84.12303
   57    54 S   CA   _C14    49     1.40731   118.62139    -1.53901
   58    57 S   HA   _H11    50     1.08827   120.96711  -179.73239
   59    55 S   N    _N4_    61     1.41178   117.06566    95.76913
   60    57 S   CA   _C15    51     1.39154   121.93572    -1.04698
   61    60 S   HA   _H12    52     1.08558   117.45898  -178.85346
   62    59 S   CT   _C4_    62     1.46609   122.15101   177.73238
   63    62 S   HC   _H3_    63     1.09397   108.54531    94.69207
   64    62 S   HC   _H4_    64     1.09134   112.26525   -26.06850
   65    62 S   HC   _H5_    65     1.09428   109.47446  -145.75954
   66    59 S   CT   _C5_    66     1.47883   123.37325    -9.09928
   67    66 S   HC   _H6_    67     1.09210   112.00731    16.71146
   68    66 S   HC   _H7_    68     1.09676   107.44246   132.84288
   69    66 S   CO3  _C6_    69     1.53190   113.11013  -105.01356
   70    69 S   O2Z  _O34    70     1.26324   115.36060    67.34336
   71    69 S   O2Z  _O33    71     1.26367   114.95353  -113.03126
  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   6   5   4   3
   9   4   3   2   1   1  12  13  11   8   4   7   6   3   4   2
   1   1   7   3   9   7  11   3   3   2  10   1   1   7   3   2
   1   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    41  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    42    54    60    41    44  
   35    39    40    41  
   39    40    41  
   37    38  
   38  
    0  
   40    42    43    45    53    54    57    60    61    41    44    47  
   42    43    45    46    51    53    54    57    58    60    41    44    55  
   44    47    48    49    50    42    54    57    58    60    61  
   43    45    46    51    52    53    54    57  
   45    46    51    54  
   47    48    49    50    57    60    61  
   46    51    52    53    54    55  
   51    52    53  
   48    49    50    60  
   49    50  
   50  
    0  
   52    53    54    57    55    56    59  
   53    54    55  
   54    57    58    60    55    56    59    62    66  
   57    58    60    61    55    56    59  
   56    59    62    63    64    65    66    67    68    69    57  
   59    62    66  
   58    60    61  
   60    61  
   62    63    64    65    66    67    68    69    70    71  
   61  
    0  
   63    64    65    66    67    68    69  
   64    65    66  
   65    66  
   66  
   67    68    69    70    71  
   68    69    70    71  
   69    70    71  
   70    71  
   71  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.2500   0.0620   0.407500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.9500   0.0530  -0.120000   2.4980   2.2250   0.001000000   0.985400000
   35   2.9500   0.0530  -0.120000   2.4980   2.2250   0.001000000   0.985400000
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0700  -0.160000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   41   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   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   0.019800   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   55   3.7500   0.1050   0.578900   2.0020   1.7750   0.023028004  -0.852763146
   56   4.1000   0.3950  -0.476200   2.3050   2.0500   0.025682759  -1.666211680
   57   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   59   3.2500   0.1700  -0.262500   1.8100   1.6000   0.054801302  -1.445846770
   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   3.5000   0.0660  -0.110000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.150000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   68   2.5000   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   69   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   71   2.9600   0.2100  -0.800000   1.7000   1.5000   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   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   367.000  1.332
   33    35   367.000  1.332
   33    39   317.000  1.510
   39    40   469.000  1.400
   39    41   469.000  1.400
   40    42   469.000  1.400
   40    54   469.000  1.400
   42    43   367.000  1.080
   42    45   469.000  1.400
   45    46   367.000  1.080
   45    51   469.000  1.400
   51    52   367.000  1.080
   51    53   469.000  1.400
   53    54   469.000  1.400
   53    55   325.000  1.464
   54    57   469.000  1.400
   57    58   367.000  1.080
   57    60   469.000  1.400
   60    61   367.000  1.080
   60    41   469.000  1.400
   41    44   450.000  1.364
   44    47   320.000  1.410
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   340.000  1.090
   55    56   340.000  1.659
   55    59   575.000  1.347
   59    62   337.000  1.449
   59    66   337.000  1.449
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   317.000  1.522
   69    70   656.000  1.250
   69    71   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    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    90.00000  110.13500
   29    33    35    90.00000  110.13500
   29    33    39    80.00000  109.48900
   33    39    40    70.00000  120.00000
   33    39    41    70.00000  120.00000
   35    33    34    77.00000  109.10000
   39    33    34    50.00000  109.50000
   39    33    35    50.00000  109.50000
   39    40    42    63.00000  120.00000
   39    40    54    63.00000  120.00000
   39    41    60    63.00000  120.00000
   39    41    44    70.00000  120.00000
   40    42    43    35.00000  120.00000
   40    42    45    63.00000  120.00000
   40    54    53    63.00000  120.00000
   40    54    57    63.00000  120.00000
   42    45    46    35.00000  120.00000
   42    45    51    63.00000  120.00000
   45    42    43    35.00000  120.00000
   45    51    52    35.00000  120.00000
   45    51    53    63.00000  120.00000
   51    45    46    35.00000  120.00000
   51    53    54    63.00000  120.00000
   51    53    55    60.00000  121.28000
   53    51    52    35.00000  120.00000
   53    54    57    63.00000  120.00000
   53    55    56    65.00000  122.13500
   53    55    59    75.00000  113.92100
   54    40    42    63.00000  120.00000
   54    57    58    35.00000  120.00000
   54    57    60    63.00000  120.00000
   57    60    61    35.00000  120.00000
   57    60    41    63.00000  120.00000
   60    57    58    35.00000  120.00000
   60    41    44    70.00000  120.00000
   41    39    40    63.00000  120.00000
   41    60    61    35.00000  120.00000
   41    44    47    75.00000  111.00000
   44    47    48    35.00000  109.50000
   44    47    49    35.00000  109.50000
   44    47    50    35.00000  109.50000
   49    47    48    33.00000  107.80000
   50    47    48    33.00000  107.80000
   50    47    49    33.00000  107.80000
   55    53    54    60.00000  121.28000
   55    59    62    70.00000  120.09200
   55    59    66    70.00000  120.09200
   59    55    56    70.00000  124.36000
   59    62    63    35.00000  109.50000
   59    62    64    35.00000  109.50000
   59    62    65    35.00000  109.50000
   59    66    67    35.00000  109.50000
   59    66    68    35.00000  109.50000
   59    66    69    63.00000  110.10000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   66    59    62    50.00000  118.00000
   66    69    70    70.00000  117.00000
   66    69    71    70.00000  117.00000
   68    66    67    33.00000  107.80000
   69    66    67    35.00000  109.50000
   69    66    68    35.00000  109.50000
   71    69    70    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    35   0.01700  1.0 1.0
   24    29    33    35  -0.23550 -1.0 2.0
   24    29    33    35   0.21350  1.0 3.0
   24    29    33    39  -0.23050  1.0 1.0
   24    29    33    39   0.06200 -1.0 2.0
   24    29    33    39   0.47200  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    39    40  -0.16000  1.0 1.0
   29    33    39    40  -0.03200 -1.0 2.0
   29    33    39    40   0.04500  1.0 3.0
   29    33    39    41  -0.16000  1.0 1.0
   29    33    39    41  -0.03200 -1.0 2.0
   29    33    39    41   0.04500  1.0 3.0
   33    39    40    42   3.62500 -1.0 2.0
   33    39    40    54   3.62500 -1.0 2.0
   33    39    41    60   3.62500 -1.0 2.0
   33    39    41    44   3.62500 -1.0 2.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    41   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    41   0.00000  1.0 1.0
   39    40    42    43   3.62500 -1.0 2.0
   39    40    42    45   3.62500 -1.0 2.0
   39    40    54    53   3.62500 -1.0 2.0
   39    40    54    57   3.62500 -1.0 2.0
   39    41    44    47   1.63200 -1.0 2.0
   40    39    41    60   3.62500 -1.0 2.0
   40    39    41    44   3.62500 -1.0 2.0
   40    42    45    46   3.62500 -1.0 2.0
   40    42    45    51   3.62500 -1.0 2.0
   40    54    57    58   3.62500 -1.0 2.0
   40    54   -57    60   3.62500 -1.0 2.0
   42    40    54    53   3.62500 -1.0 2.0
   42    40    54    57   3.62500 -1.0 2.0
   42    45    51    52   3.62500 -1.0 2.0
   42    45   -51    53   3.62500 -1.0 2.0
   43    42    45    46   3.62500 -1.0 2.0
   43    42    45    51   3.62500 -1.0 2.0
   45    51    53    54   3.62500 -1.0 2.0
   45    51    53    55   3.62500 -1.0 2.0
   46    45    51    52   3.62500 -1.0 2.0
   46    45    51    53   3.62500 -1.0 2.0
   51    53   -54    40   3.62500 -1.0 2.0
   51    53    54    57   3.62500 -1.0 2.0
   51    53    55    56   1.00000 -1.0 2.0
   51    53    55    59   0.75700  1.0 1.0
   51    53    55    59   0.34650 -1.0 2.0
   51    53    55    59   0.33000  1.0 3.0
   51    53    55    59  -0.28100 -1.0 4.0
   52    51    53    54   3.62500 -1.0 2.0
   52    51    53    55   3.62500 -1.0 2.0
   53    54    57    58   3.62500 -1.0 2.0
   53    54    57    60   3.62500 -1.0 2.0
   53    55    59    62   1.49850  1.0 1.0
   53    55    59    62   1.53950 -1.0 2.0
   53    55    59    66   1.49850  1.0 1.0
   53    55    59    66   1.53950 -1.0 2.0
   54    40    42    43   3.62500 -1.0 2.0
   54    40   -42    45   3.62500 -1.0 2.0
   54    53    55    56   1.00000 -1.0 2.0
   54    53    55    59   0.75700  1.0 1.0
   54    53    55    59   0.34650 -1.0 2.0
   54    53    55    59   0.33000  1.0 3.0
   54    53    55    59  -0.28100 -1.0 4.0
   54    57    60    61   3.62500 -1.0 2.0
   54    57    60    41   3.62500 -1.0 2.0
   57    60   -41    39   3.62500 -1.0 2.0
   57    60    41    44   3.62500 -1.0 2.0
   58    57    60    61   3.62500 -1.0 2.0
   58    57    60    41   3.62500 -1.0 2.0
   60    41    44    47   1.63200 -1.0 2.0
   61    60    41    39   3.62500 -1.0 2.0
   61    60    41    44   3.62500 -1.0 2.0
   41    39    40    42   3.62500 -1.0 2.0
   41    39   -40    54   3.62500 -1.0 2.0
   41    44    47    48   0.08050  1.0 3.0
   41    44    47    49   0.08050  1.0 3.0
   41    44    47    50   0.08050  1.0 3.0
   55    53    54    40   3.62500 -1.0 2.0
   55    53    54    57   3.62500 -1.0 2.0
   55    59    62    63   0.00000  1.0 1.0
   55    59    62    64   0.00000  1.0 1.0
   55    59    62    65   0.00000  1.0 1.0
   55    59    66    67   0.00000  1.0 1.0
   55    59    66    68   0.00000  1.0 1.0
   55    59    66    69  -0.29800  1.0 1.0
   55    59    66    69   0.13950 -1.0 2.0
   55    59    66    69  -2.45650  1.0 3.0
   56    55    59    62   3.39850 -1.0 2.0
   56    55    59    66   3.39850 -1.0 2.0
   59    66    69    70   0.00000  1.0 1.0
   59    66    69    71   0.00000  1.0 1.0
   62    59    66    67   0.00000  1.0 1.0
   62    59    66    68   0.00000  1.0 1.0
   62    59    66    69   0.17850 -1.0 2.0
   66    59    62    63   0.00000  1.0 1.0
   66    59    62    64   0.00000  1.0 1.0
   66    59    62    65   0.00000  1.0 1.0
   67    66    69    70   0.00000  1.0 1.0
   67    66    69    71   0.00000  1.0 1.0
   68    66    69    70   0.00000  1.0 1.0
   68    66    69    71   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
   37    30    36    38  10.50000 -1.0 2.0
   40    41    39    33   4.00000 -1.0 2.0
   42    54    40    39   4.00000 -1.0 2.0
   45    43    42    40   1.10000 -1.0 2.0
   51    46    45    42   1.10000 -1.0 2.0
   53    52    51    45   1.10000 -1.0 2.0
   54    55    53    51   4.00000 -1.0 2.0
   53    57    54    40   4.00000 -1.0 2.0
   60    58    57    54   1.10000 -1.0 2.0
   41    61    60    57   1.10000 -1.0 2.0
   60    44    41    39   4.00000 -1.0 2.0
   53    59    55    56  10.50000 -1.0 2.0
   66    55    59    62   1.00000 -1.0 2.0
   70    66    69    71  10.50000 -1.0 2.0
END
