* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    131    197     376
    1     0 S   NP   _N1_     1    28.15465    96.60628   -20.93469
    2     1 S   H    _HN1     2     1.02776    93.07615  -112.28864
    3     1 S   H    _H1_     3     1.02957    76.02303    -4.15001
    4     1 S   H    _H2_     4     1.02835    41.23273   133.78715
    5     1 S   CT   _CA1     5     1.50125   148.92629   102.25926
    6     5 S   HC   _HA1     6     1.09575   105.21968    80.79397
    7     5 S   CO3  _C1_     7     1.53788   112.37047   -39.40706
    8     7 S   O2Z  _O11     8     1.26365   114.99761   -43.85518
    9     7 S   O2Z  _O12     9     1.26237   114.93190   135.26989
   10     5 S   CT   _CB1    10     1.53099   107.42443  -161.29078
   11    10 S   HC   HB11    11     1.09826   109.33822   -50.54371
   12    10 S   HC   HB12    12     1.09816   110.42472    66.01444
   13    10 S   CT   _CG1    13     1.53013   112.66344  -171.61723
   14    13 S   HC   HG11    14     1.09595   110.48667   -64.27642
   15    13 S   HC   HG12    15     1.09657   109.92163    54.92127
   16    13 S   C    _CD1    16     1.51838   112.33238   175.29489
   17    16 S   O    _OE1    17     1.22748   123.30218     0.12667
   18    16 S   N    _N2_    18     1.38561   111.69515  -179.90721
   19    18 S   H    _HN2    19     1.01563   118.98851     4.62398
   20    18 S   CT1  _CA2    20     1.45820   122.91206   177.86641
   21    20 S   HC   _HA2    21     1.09734   108.96674    22.67880
   22    20 S   C    _C2_    22     1.52916   107.07228   -94.30492
   23    22 S   O    _O2_    23     1.22966   123.06193   -26.41649
   24    20 S   CT   _CB2    32     1.53230   112.17980   145.80766
   25    24 S   HC   HB21    33     1.09500   109.96403    53.76385
   26    24 S   HC   HB22    34     1.09454   109.93350   172.64497
   27    22 S   N    _N3_    24     1.38492   112.50908   156.33892
   28    27 S   H    _HN3    25     1.01651   120.34985    -2.19704
   29    24 S   S    _SG2    35     1.82712   110.86653   -67.08414
   30    27 S   CT   _CA3    26     1.45354   122.54923   178.54169
   31    30 S   HC   HA31    27     1.09565   107.85363   -55.17823
   32    30 S   HC   HA32    28     1.09561   107.58682    61.18234
   33    29 S   CT   _C15    36     1.85221   100.46961  -175.87517
   34    30 S   CO3  _C3_    29     1.52905   114.26058  -177.06855
   35    34 S   O2Z  _O31    30     1.26348   116.03750     0.92831
   36    34 S   O2Z  _O32    31     1.26432   114.42365  -179.12062
   37    33 S   CM   _C10    37     1.51137   108.46111   174.47068
   38    37 S   HC   _H25    38     1.09154   115.59346   -50.77605
   39    33 S   OS   _O20    67     1.44150   112.90150    50.43620
   40    37 S   CMA  _C11    39     1.35743   126.80052   128.05302
   41    40 S   OM   _O16    40     1.26579   123.28340  -177.47369
   42    39 S   CT   _C16    68     1.42128   117.18137    68.90989
   43    42 S   HC   _H31    69     1.09384   107.78470  -172.60856
   44    42 S   HC   _H32    70     1.09348   110.88823    69.80424
   45    42 S   HC   _H33    71     1.09287   111.93594   -53.98631
   46    40 S   OS   _O19    41     1.40618   116.85109     2.02796
   47    46 S   CT   _C14    42     1.43208   117.53121    20.90650
   48    47 S   HC   _H30    43     1.09840   108.84862    67.11303
   49    33 S   CT   _C12    44     1.53660   108.33945   -66.81959
   50    49 S   HC   _H26    45     1.09676   111.01623    80.80970
   51    49 S   HC   _H27    46     1.09881   111.00994   -39.88637
   52    47 S   CT   _C18    47     1.53491   108.16783  -174.84908
   53    52 S   HC   _H36    48     1.09730   109.52671   175.61001
   54    52 S   HC   _H37    49     1.09805   109.52532    58.38335
   55    52 S   CT   _C17    50     1.53311   111.98542   -62.47302
   56    55 S   HC   _H34    51     1.09707   110.64577    60.10653
   57    55 S   HC   _H35    52     1.09735   110.10323   -56.67546
   58    55 S   CA   _C7_    53     1.50917   111.53957  -178.24777
   59    58 S   CA   _C4_    54     1.41310   120.12990    90.06070
   60    59 S   HA   _H22    55     1.08776   119.94869     0.76208
   61    59 S   CA   _C5_    56     1.39781   120.99012  -179.15953
   62    61 S   HA   _H23    57     1.08404   120.88209  -179.89532
   63    61 S   CA   _C8_    58     1.37850   117.70967     0.22468
   64    63 S   CA   _C9_    59     1.37508   121.73993     0.06853
   65    58 S   CA   _C6_    60     1.40367   120.18201   -88.57783
   66    65 S   HA   _H24    61     1.08508   121.19290    -0.77354
   67    64 S   OS   _O18    62     1.36098   112.34193   179.82529
   68    67 S   CO   _C13    63     1.44223   100.97034     0.07662
   69    68 S   HC   _H28    64     1.09609   108.66638  -121.01706
   70    68 S   HC   _H29    65     1.09611   108.67168   120.83560
   71    63 S   OS   _O17    66     1.36074   125.89302   179.91844
  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  10   5   4   3
  16   2   1   1  10   5   9   6   2   4   2   1   1   9  11   7
   6   2   1   8   5   4   9   4   3   9   8   4   7   3   8   7
   4   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    40    47    49    50    51    39    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    40    41    46    47    48    49    50    51    52    39    42    43    44    45  
   35    36  
   36  
    0  
   38    40    41    46    47    49    50    51    39    42  
   40    41    46    49    39  
   42    43    44    45    40    47    49    50    51  
   41    46    47    48    49    52  
   46    47  
   43    44    45    49  
   44    45  
   45  
    0  
   47    48    49    50    51    52    53    54    55  
   48    49    50    51    52    53    54    55    56    57    58  
   49    50    51    52    53    54    55  
   50    51    52    53    54    55  
   51    52  
   52  
   53    54    55    56    57    58    59    65  
   54    55    56    57    58  
   55    56    57    58  
   56    57    58    59    60    61    64    65    66  
   57    58    59    65  
   58    59    65  
   59    60    61    62    63    64    65    66    67  
   60    61    62    63    64    65    66    71  
   61    62    63    65  
   62    63    64    65    67    68    71  
   63    64    71  
   64    65    66    67    68    69    70    71  
   65    66    67    68    69    70    71  
   66    67    68    71  
   67  
   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  -0.316400   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   0.417900   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   3.5500   0.0760  -0.785200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   46   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   47   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   60   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   61   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   62   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   63   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   64   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   68   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   71   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    49   268.000  1.529
   33    39   320.000  1.410
   37    38   340.000  1.080
   37    40   465.000  1.376
   40    41   745.000  1.250
   40    46   440.000  1.360
   46    47   320.000  1.410
   47    48   340.000  1.090
   47    49   268.000  1.529
   47    52   268.000  1.529
   49    50   340.000  1.090
   49    51   340.000  1.090
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   268.000  1.529
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   317.000  1.510
   58    59   469.000  1.400
   58    65   469.000  1.400
   59    60   367.000  1.080
   59    61   469.000  1.400
   61    62   367.000  1.080
   61    63   469.000  1.400
   63    64   469.000  1.400
   63    71   450.000  1.364
   64    65   469.000  1.400
   64    67   450.000  1.364
   65    66   367.000  1.080
   67    68   320.000  1.380
   68    69   340.000  1.090
   68    70   340.000  1.090
   68    71   320.000  1.380
   39    42   320.000  1.410
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    49    75.00000  111.63000
   29    33    39    85.00000  114.68000
   33    37    38    35.00000  117.00000
   33    37    40    70.00000  124.00000
   33    49    47    58.35000  112.70000
   33    49    50    37.50000  110.70000
   33    49    51    37.50000  110.70000
   33    39    42    60.00000  109.50000
   37    40    41    65.00000  137.10300
   37    40    46    80.00000  120.01400
   40    37    38    40.00000  120.50800
   40    46    47    90.00000  111.18400
   46    40    41    65.00000  121.00000
   46    47    48    35.00000  109.50000
   46    47    49    50.00000  109.50000
   46    47    52    50.00000  109.50000
   47    49    50    37.50000  110.70000
   47    49    51    37.50000  110.70000
   47    52    53    37.50000  110.70000
   47    52    54    37.50000  110.70000
   47    52    55    58.35000  112.70000
   49    33    37    70.00000  112.02700
   49    47    48    37.50000  110.70000
   51    49    50    33.00000  107.80000
   52    47    48    37.50000  110.70000
   52    47    49    58.35000  112.70000
   52    55    56    37.50000  110.70000
   52    55    57    37.50000  110.70000
   52    55    58    70.00000  112.17500
   54    52    53    33.00000  107.80000
   55    52    53    37.50000  110.70000
   55    52    54    37.50000  110.70000
   55    58    59    70.00000  120.00000
   55    58    65    70.00000  120.00000
   57    55    56    33.00000  107.80000
   58    55    56    35.00000  109.50000
   58    55    57    35.00000  109.50000
   58    59    60    35.00000  120.00000
   58    59    61    63.00000  120.00000
   58    65    64    63.00000  120.00000
   58    65    66    35.00000  120.00000
   59    61    62    35.00000  120.00000
   59    61    63    63.00000  120.00000
   61    59    60    35.00000  120.00000
   61    63    64    63.00000  120.00000
   61    63    71    70.00000  120.00000
   63    61    62    35.00000  120.00000
   63    64    65    63.00000  120.00000
   63    64    67    70.00000  120.00000
   63    71    68   100.00000  112.36700
   64    65    66    35.00000  120.00000
   64    67    68   100.00000  112.36700
   65    58    59    63.00000  120.00000
   67    64    65    70.00000  120.00000
   67    68    69    35.00000  109.50000
   67    68    70    35.00000  109.50000
   67    68    71    92.60000  111.55000
   70    68    69    33.00000  109.50000
   71    63    64    70.00000  120.00000
   71    68    69    35.00000  109.50000
   71    68    70    35.00000  109.50000
   39    33    37    85.00000  110.90400
   39    33    49    50.00000  109.50000
   39    42    43    35.00000  109.50000
   39    42    44    35.00000  109.50000
   39    42    45    35.00000  109.50000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   24    29    33    39   0.13850  1.0 1.0
   24    29    33    39  -1.34450 -1.0 2.0
   24    29    33    39   0.57400  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   0.00000  1.0 1.0
   29    33    37    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  1.0 3.0
   29    33    49    47   0.44750  1.0 1.0
   29    33    49    47  -0.17800 -1.0 2.0
   29    33    49    47   0.20200  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    51   0.15000  1.0 3.0
   29    33    39    42   0.14700  1.0 1.0
   29    33    39    42  -1.16150 -1.0 2.0
   29    33    39    42   0.48700  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    46   7.00000 -1.0 2.0
   33    39    42    43   0.37050  1.0 3.0
   33    39    42    44   0.37050  1.0 3.0
   33    39    42    45   0.37050  1.0 3.0
   37    33    49    47   0.34400  1.0 1.0
   37    33    49    47   0.09450 -1.0 2.0
   37    33    49    47   0.11100  1.0 3.0
   37    33    49    50   0.15000  1.0 3.0
   37    33    49    51   0.15000  1.0 3.0
   37    33    39    42  -0.77900  1.0 1.0
   37    33    39    42  -0.36900 -1.0 2.0
   37    33    39    42   0.40400  1.0 3.0
   37    40   -46    47  -2.26850  1.0 1.0
   37    40   -46    47   3.39050 -1.0 2.0
   38    37    40    41   7.00000 -1.0 2.0
   38    37    40    46   7.00000 -1.0 2.0
   40    46    47    48   0.08050  1.0 3.0
   40    46    47    49  -0.46850  1.0 1.0
   40    46    47    49   0.09300 -1.0 2.0
   40    46    47    49  -0.12850  1.0 3.0
   40    46    47    52  -0.46850  1.0 1.0
   40    46    47    52   0.09300 -1.0 2.0
   40    46    47    52  -0.12850  1.0 3.0
   41    40    46    47   2.00000 -1.0 2.0
   46    47   -49    33   0.62750  1.0 1.0
   46    47   -49    33  -0.30950 -1.0 2.0
   46    47   -49    33   0.27300  1.0 3.0
   46    47    49    50   0.23400  1.0 3.0
   46    47    49    51   0.23400  1.0 3.0
   46    47    52    53   0.23400  1.0 3.0
   46    47    52    54   0.23400  1.0 3.0
   46    47    52    55   0.62750  1.0 1.0
   46    47    52    55  -0.30950 -1.0 2.0
   46    47    52    55   0.27300  1.0 3.0
   47    52    55    56   0.15000  1.0 3.0
   47    52    55    57   0.15000  1.0 3.0
   47    52    55    58  -0.03700  1.0 1.0
   47    52    55    58   0.37200 -1.0 2.0
   47    52    55    58  -0.47300  1.0 3.0
   48    47    49    33   0.15000  1.0 3.0
   48    47    49    50   0.15000  1.0 3.0
   48    47    49    51   0.15000  1.0 3.0
   48    47    52    53   0.15000  1.0 3.0
   48    47    52    54   0.15000  1.0 3.0
   48    47    52    55   0.15000  1.0 3.0
   49    33    37    38   0.00000  1.0 1.0
   49    33   -37    40   0.09850  1.0 1.0
   49    33   -37    40   0.15250 -1.0 2.0
   49    33   -37    40  -0.50650  1.0 3.0
   49    33    39    42   0.06250  1.0 1.0
   49    33    39    42  -0.01100 -1.0 2.0
   49    33    39    42   0.28050  1.0 3.0
   49    47    52    53   0.15000  1.0 3.0
   49    47    52    54   0.15000  1.0 3.0
   49    47    52    55   0.56750  1.0 1.0
   49    47    52    55  -0.07550 -1.0 2.0
   49    47    52    55   0.20000  1.0 3.0
   52    47    49    33   0.56750  1.0 1.0
   52    47    49    33  -0.07550 -1.0 2.0
   52    47    49    33   0.20000  1.0 3.0
   52    47    49    50   0.15000  1.0 3.0
   52    47    49    51   0.15000  1.0 3.0
   52    55    58    59   0.04150 -1.0 2.0
   52    55    58    65   0.04150 -1.0 2.0
   53    52    55    56   0.15000  1.0 3.0
   53    52    55    57   0.15000  1.0 3.0
   53    52    55    58   0.43200  1.0 3.0
   54    52    55    56   0.15000  1.0 3.0
   54    52    55    57   0.15000  1.0 3.0
   54    52    55    58   0.43200  1.0 3.0
   55    58    59    60   3.62500 -1.0 2.0
   55    58    59    61   3.62500 -1.0 2.0
   55    58    65    64   3.62500 -1.0 2.0
   55    58    65    66   3.62500 -1.0 2.0
   56    55    58    59   0.00000  1.0 1.0
   56    55    58    65   0.00000  1.0 1.0
   57    55    58    59   0.00000  1.0 1.0
   57    55    58    65   0.00000  1.0 1.0
   58    59    61    62   3.62500 -1.0 2.0
   58    59    61    63   3.62500 -1.0 2.0
   59    58    65    64   3.62500 -1.0 2.0
   59    58    65    66   3.62500 -1.0 2.0
   59    61   -63    64   3.62500 -1.0 2.0
   59    61    63    71   3.62500 -1.0 2.0
   60    59    61    62   3.62500 -1.0 2.0
   60    59    61    63   3.62500 -1.0 2.0
   61    63    64    65   3.62500 -1.0 2.0
   61    63    64    67   3.62500 -1.0 2.0
   61    63    71    68   1.63200 -1.0 2.0
   62    61    63    64   3.62500 -1.0 2.0
   62    61    63    71   3.62500 -1.0 2.0
   63    64   -65    58   3.62500 -1.0 2.0
   63    64    65    66   3.62500 -1.0 2.0
   63    64   -67    68   1.63200 -1.0 2.0
   64    63   -71    68   1.63200 -1.0 2.0
   64    67    68    69   0.08050  1.0 3.0
   64    67    68    70   0.08050  1.0 3.0
   64    67   -68    71  -0.25600  1.0 1.0
   64    67   -68    71  -0.40050 -1.0 2.0
   64    67   -68    71   0.34700  1.0 3.0
   65    58    59    60   3.62500 -1.0 2.0
   65    58   -59    61   3.62500 -1.0 2.0
   65    64    67    68   1.63200 -1.0 2.0
   67    64    65    58   3.62500 -1.0 2.0
   67    64    65    66   3.62500 -1.0 2.0
   67    68   -71    63  -0.25600  1.0 1.0
   67    68   -71    63  -0.40050 -1.0 2.0
   67    68   -71    63   0.34700  1.0 3.0
   69    68    71    63   0.08050  1.0 3.0
   70    68    71    63   0.08050  1.0 3.0
   71    63    64    65   3.62500 -1.0 2.0
   71    63   -64    67   3.62500 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    40   0.39000  1.0 1.0
   39    33    37    40  -0.05800 -1.0 2.0
   39    33    37    40  -0.55150  1.0 3.0
   39    33    49    47   0.62750  1.0 1.0
   39    33    49    47  -0.30950 -1.0 2.0
   39    33    49    47   0.27300  1.0 3.0
   39    33    49    50   0.23400  1.0 3.0
   39    33    49    51   0.23400  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    34    35  10.50000 -1.0 2.0
   33    38    37    40   1.10000 -1.0 2.0
   41    46    40    37   1.10000 -1.0 2.0
   59    65    58    55   4.00000 -1.0 2.0
   61    60    59    58   1.10000 -1.0 2.0
   63    62    61    59   1.10000 -1.0 2.0
   64    71    63    61   4.00000 -1.0 2.0
   65    67    64    63   4.00000 -1.0 2.0
   64    66    65    58   1.10000 -1.0 2.0
END
