* LIGAND DATABASE FILE (OPLS2005)
*
001      69    70    122    182     348
    1     0 S   NP   _N1_     1    30.92931    94.88334   -27.82843
    2     1 S   H    _HN1     2     1.02943   104.90303   -33.82233
    3     1 S   H    _H1_     3     1.02823    11.32902  -136.52130
    4     1 S   H    _H2_     4     1.02808   118.68125  -154.94699
    5     1 S   CT   _CA1     5     1.50086   101.93886    81.38055
    6     5 S   HC   _HA1     6     1.09557   105.24567    66.58241
    7     5 S   CO3  _C1_     7     1.53797   112.53625   -53.93007
    8     7 S   O2Z  _O11     8     1.26388   115.02115   -41.54844
    9     7 S   O2Z  _O12     9     1.26230   114.98071   137.76398
   10     5 S   CT   _CB1    10     1.53017   107.43737  -175.17436
   11    10 S   HC   HB11    11     1.09848   109.67058   -47.78050
   12    10 S   HC   HB12    12     1.09727   110.25419    68.68493
   13    10 S   CT   _CG1    13     1.53018   112.59539  -168.50878
   14    13 S   HC   HG11    14     1.09498   111.16275   -63.07537
   15    13 S   HC   HG12    15     1.09640   109.45482    56.05092
   16    13 S   C    _CD1    16     1.51695   111.54598   177.11758
   17    16 S   O    _OE1    17     1.22786   122.99314    23.44318
   18    16 S   N    _N2_    18     1.38620   112.18025  -157.10845
   19    18 S   H    _HN2    19     1.01560   119.16729     2.11748
   20    18 S   CT1  _CA2    20     1.46047   123.11565   177.08879
   21    20 S   HC   _HA2    21     1.09628   109.12123    11.50093
   22    20 S   C    _C2_    22     1.53772   109.52609  -103.89147
   23    22 S   O    _O2_    23     1.23106   121.98704  -151.56241
   24    20 S   CT   _CB2    32     1.53329   111.81435   133.61389
   25    24 S   HC   HB21    33     1.09655   109.73713    65.15061
   26    24 S   HC   HB22    34     1.09585   110.60088  -177.67182
   27    22 S   N    _N3_    24     1.38220   114.12587    35.81348
   28    27 S   H    _HN3    25     1.01503   119.69799    -3.00596
   29    24 S   S    _SG2    35     1.82779   115.17354   -55.02512
   30    27 S   CT   _CA3    26     1.45286   123.40431   177.35544
   31    30 S   HC   HA31    27     1.09544   107.50393   -65.36861
   32    30 S   HC   HA32    28     1.09552   108.03744    51.13529
   33    29 S   CT   _C16    36     1.81629   100.05231   -58.56161
   34    33 S   HC   _H14    37     1.08899   110.05881    73.39351
   35    33 S   HC   _H15    38     1.09544   109.73291   -44.88457
   36    30 S   CO3  _C3_    29     1.53012   113.93947   173.12942
   37    36 S   O2Z  _O31    30     1.26404   116.05857    -0.72362
   38    36 S   O2Z  _O32    31     1.26417   114.43199   179.33914
   39    33 S   C    _C15    39     1.52129   108.91278  -161.78408
   40    39 S   O    _O33    40     1.23656   118.95468    71.19770
   41    39 S   N    _N4_    41     1.39715   118.47774  -110.10444
   42    41 S   CA   _C10    42     1.42329   123.77292     3.57166
   43    41 S   CT   _C11    59     1.46958   120.00390  -174.53266
   44    43 S   HC   _H9_    60     1.09633   109.95930    24.68605
   45    43 S   HC   _H10    61     1.09595   110.12501   142.55308
   46    42 S   CA   _C5_    43     1.41197   120.51017    85.41182
   47    43 S   NA   _N5_    62     1.45461   115.00567   -95.73089
   48    46 S   CA   _C6_    44     1.40369   118.80491   176.79051
   49    48 S   HA   _H6_    45     1.08824   120.11165  -179.05477
   50    46 S   CT   _C4_    55     1.50353   124.11243    -1.16584
   51    50 S   HC   _H3_    56     1.09558   109.96289  -129.52182
   52    50 S   HC   _H4_    57     1.09139   113.16248    -9.87751
   53    50 S   HC   _H5_    58     1.09470   109.87536   110.82449
   54    47 S   C5A  _C12    63     1.36634   126.35614  -103.89599
   55    54 S   HA   _H11    64     1.08129   122.16381     1.20073
   56    48 S   CA   _C7_    46     1.39184   121.03085     0.64102
   57    56 S   HA   _H7_    47     1.08637   119.88896  -179.90721
   58    54 S   C5BD _C13    65     1.37436   105.88467  -179.28618
   59    58 S   HA   _H12    66     1.07999   127.00476  -179.58741
   60    56 S   CA   _C8_    48     1.39129   119.99276     0.22814
   61    60 S   HA   _H8_    49     1.08746   118.87285   179.81443
   62    58 S   C5BB _C14    67     1.40722   104.59771     0.44806
   63    62 S   HA   _H13    68     1.08073   128.46333   179.93439
   64    42 S   CA   _C9_    50     1.41516   119.16242   -96.17243
   65    47 S   N5A  _N6_    69     1.34755   120.05582    77.75758
   66    64 S   CT   _C17    51     1.50498   122.30500     2.05538
   67    66 S   HC   _H16    52     1.09389   110.28526   -77.95214
   68    66 S   HC   _H17    53     1.09435   111.11185    43.62228
   69    66 S   HC   _H18    54     1.09553   111.16677   162.21240
  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
   7   4   3   2   1   1   9   3  13  19  10   4   3  11   7  10
   4   5   2   1   1   6   4   5   3   4   3   6   2   2   1   4
   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    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    41    42    43  
   35    39    40    41  
   39    40    41  
   37    38  
   38  
    0  
   40    41    42    46    64    43    44    45    47  
   41    42    43  
   42    46    48    60    64    66    50    43    44    45    47    54    65  
   46    48    49    56    60    61    64    66    67    68    69    50    51    52    53    43    44    45    47  
   44    45    47    54    55    58    62    65    46    64  
   45    47    54    65  
   47    54    65  
   48    49    56    57    60    64    66    50    51    52    53  
   54    55    58    59    62    63    65  
   49    56    57    60    61    64    50    51    52    53  
   56    57    60    50  
   51    52    53    56    64  
   52    53  
   53  
    0  
   55    58    59    62    63    65  
   58    59    62    65  
   57    60    61    64    66  
   60    61    64  
   59    62    63    65  
   62    63    65  
   61    64    66    67    68    69  
   64    66  
   63    65  
   65  
   66    67    68    69  
    0  
   67    68    69  
   68    69  
   69  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   41   3.2500   0.1700  -0.031700   1.8100   1.6000   0.054801302  -1.445846770
   42   3.5500   0.0700  -0.038300   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5000   0.0660   0.072500   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   46   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.2500   0.1700   0.069500   1.8650   1.6500   0.001000000  -0.511443539
   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  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700   0.036000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.135000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5500   0.0700  -0.115000   2.0020   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  -0.320000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.150000   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   0.266000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.072000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   65   3.2500   0.1700  -0.531000   1.8650   1.6500   0.001000000  -0.511443539
   66   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   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    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   340.000  1.090
   33    35   340.000  1.090
   33    39   317.000  1.522
   39    40   570.000  1.229
   39    41   490.000  1.335
   41    42   360.000  1.404
   41    43   337.000  1.449
   42    46   469.000  1.400
   42    64   469.000  1.400
   46    48   469.000  1.400
   46    50   317.000  1.510
   48    49   367.000  1.080
   48    56   469.000  1.400
   56    57   367.000  1.080
   56    60   469.000  1.400
   60    61   367.000  1.080
   60    64   469.000  1.400
   64    66   317.000  1.510
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    47   320.000  1.443
   47    54   427.000  1.381
   47    65   400.000  1.349
   54    55   367.000  1.080
   54    58   546.000  1.367
   58    59   367.000  1.080
   58    62   469.000  1.421
   62    63   367.000  1.080
   62    65   410.000  1.320
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    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    70.00000  112.33000
   33    39    40    80.00000  120.40000
   33    39    41    70.00000  116.60000
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    41    42    65.00000  121.96500
   39    41    43    50.00000  121.90000
   41    39    40    80.00000  122.90000
   41    42    46    70.00000  119.01900
   41    42    64    70.00000  119.01900
   41    43    44    35.00000  109.50000
   41    43    45    35.00000  109.50000
   41    43    47    85.00000  109.00000
   42    46    48    63.00000  120.00000
   42    46    50    70.00000  120.00000
   42    64    60    63.00000  120.00000
   42    64    66    70.00000  120.00000
   46    48    49    35.00000  120.00000
   46    48    56    63.00000  120.00000
   46    50    51    35.00000  109.50000
   46    50    52    35.00000  109.50000
   46    50    53    35.00000  109.50000
   48    56    57    35.00000  120.00000
   48    56    60    63.00000  120.00000
   56    48    49    35.00000  120.00000
   56    60    61    35.00000  120.00000
   56    60    64    63.00000  120.00000
   60    56    57    35.00000  120.00000
   60    64    66    70.00000  120.00000
   64    42    46    63.00000  120.00000
   64    60    61    35.00000  120.00000
   64    66    67    35.00000  109.50000
   64    66    68    35.00000  109.50000
   64    66    69    35.00000  109.50000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   50    46    48    70.00000  120.00000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   43    41    42    70.00000  121.06000
   43    47    54    65.00000  127.50000
   43    47    65    75.00000  118.68000
   45    43    44    33.00000  107.80000
   47    43    44    50.00000  108.61900
   47    43    45    50.00000  108.61900
   47    54    55    35.00000  121.60000
   47    54    58    70.00000  109.00000
   47    65    62    70.00000  104.10000
   54    58    59    35.00000  126.90000
   54    58    62    70.00000  103.80000
   58    54    55    35.00000  130.70000
   58    62    63    35.00000  128.60000
   58    62    65    70.00000  111.90000
   62    58    59    35.00000  128.20000
   65    47    54    56.00000  113.10000
   65    62    63    35.00000  118.90000
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   0.32350  1.0 3.0
   24    29    33    35   0.32350  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    39    40   0.30150 -1.0 2.0
   29    33    39    41   0.00000  1.0 1.0
   33    39    41    42   0.76000  1.0 1.0
   33    39    41    42   4.11600 -1.0 2.0
   33    39    41    43   1.49850  1.0 1.0
   33    39    41    43   1.53950 -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    41    42    46   1.00100  1.0 1.0
   39    41    42    46   0.85050 -1.0 2.0
   39    41    42    64   1.00100  1.0 1.0
   39    41    42    64   0.85050 -1.0 2.0
   39    41    43    44   0.00000  1.0 1.0
   39    41    43    45   0.00000  1.0 1.0
   39    41    43    47  -0.42300  1.0 1.0
   39    41    43    47  -0.07000 -1.0 2.0
   39    41    43    47   0.04150  1.0 3.0
   40    39    41    42   0.04000 -1.0 2.0
   40    39    41    43   3.04450 -1.0 2.0
   41    42    46    48   3.62500 -1.0 2.0
   41    42    46    50   3.62500 -1.0 2.0
   41    42    64    60   3.62500 -1.0 2.0
   41    42    64    66   3.62500 -1.0 2.0
   41    43    47    54   0.68100  1.0 1.0
   41    43    47    54   0.03350 -1.0 2.0
   41    43    47    54   0.36200  1.0 3.0
   41    43    47    65   0.68100  1.0 1.0
   41    43    47    65   0.03350 -1.0 2.0
   41    43    47    65   0.36200  1.0 3.0
   42    41    43    44   0.00000  1.0 1.0
   42    41    43    45   0.00000  1.0 1.0
   42    41    43    47   0.17850 -1.0 2.0
   42    46    48    49   3.62500 -1.0 2.0
   42    46    48    56   3.62500 -1.0 2.0
   42    46    50    51   0.00000  1.0 1.0
   42    46    50    52   0.00000  1.0 1.0
   42    46    50    53   0.00000  1.0 1.0
   42    64    66    67   0.00000  1.0 1.0
   42    64    66    68   0.00000  1.0 1.0
   42    64    66    69   0.00000  1.0 1.0
   46    42    64    60   3.62500 -1.0 2.0
   46    42    64    66   3.62500 -1.0 2.0
   46    48    56    57   3.62500 -1.0 2.0
   46    48   -56    60   3.62500 -1.0 2.0
   48    46    50    51   0.00000  1.0 1.0
   48    46    50    52   0.00000  1.0 1.0
   48    46    50    53   0.00000  1.0 1.0
   48    56    60    61   3.62500 -1.0 2.0
   48    56    60    64   3.62500 -1.0 2.0
   49    48    56    57   3.62500 -1.0 2.0
   49    48    56    60   3.62500 -1.0 2.0
   56    60   -64    42   3.62500 -1.0 2.0
   56    60    64    66   3.62500 -1.0 2.0
   57    56    60    61   3.62500 -1.0 2.0
   57    56    60    64   3.62500 -1.0 2.0
   60    64    66    67   0.00000  1.0 1.0
   60    64    66    68   0.00000  1.0 1.0
   60    64    66    69   0.00000  1.0 1.0
   61    60    64    42   3.62500 -1.0 2.0
   61    60    64    66   3.62500 -1.0 2.0
   64    42   -46    48   3.62500 -1.0 2.0
   64    42    46    50   3.62500 -1.0 2.0
   50    46    48    49   3.62500 -1.0 2.0
   50    46    48    56   3.62500 -1.0 2.0
   43    41    42    46   0.81400  1.0 1.0
   43    41    42    46   1.55550 -1.0 2.0
   43    41    42    64   0.81400  1.0 1.0
   43    41    42    64   1.55550 -1.0 2.0
   43    47    54    55   3.62500 -1.0 2.0
   43    47    54    58   3.62500 -1.0 2.0
   43    47    65    62   3.62500 -1.0 2.0
   44    43    47    54   0.00000  1.0 1.0
   44    43    47    65   0.00000  1.0 1.0
   45    43    47    54   0.00000  1.0 1.0
   45    43    47    65   0.00000  1.0 1.0
   47    54    58    59   3.62500 -1.0 2.0
   47    54   -58    62   3.62500 -1.0 2.0
   54    47   -65    62   3.62500 -1.0 2.0
   54    58    62    63   3.62500 -1.0 2.0
   54    58   -62    65   3.62500 -1.0 2.0
   55    54    58    59   3.62500 -1.0 2.0
   55    54    58    62   3.62500 -1.0 2.0
   58    62   -65    47   3.62500 -1.0 2.0
   59    58    62    63   3.62500 -1.0 2.0
   59    58    62    65   3.62500 -1.0 2.0
   63    62    65    47   3.62500 -1.0 2.0
   65    47    54    55   3.62500 -1.0 2.0
   65    47   -54    58   3.62500 -1.0 2.0
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
   33    41    39    40  10.50000 -1.0 2.0
   43    39    41    42   1.00000 -1.0 2.0
   46    64    42    41   4.00000 -1.0 2.0
   48    50    46    42   4.00000 -1.0 2.0
   56    49    48    46   1.10000 -1.0 2.0
   60    57    56    48   1.10000 -1.0 2.0
   64    61    60    56   1.10000 -1.0 2.0
   60    66    64    42   4.00000 -1.0 2.0
   54    65    47    43   4.00000 -1.0 2.0
   58    55    54    47   1.10000 -1.0 2.0
   62    59    58    54   1.10000 -1.0 2.0
   65    63    62    58   1.10000 -1.0 2.0
END
