* LIGAND DATABASE FILE (OPLS2005)
*
001      60    60    105    159     309
    1     0 S   NP   _N1_     1    28.03047    96.10378   -24.76413
    2     1 S   H    _HN1     2     1.02958    81.97059    -9.85169
    3     1 S   H    _H1_     3     1.02836    25.82617   156.49383
    4     1 S   H    _H2_     4     1.02775   111.37584  -116.46772
    5     1 S   CT   _CA1     5     1.50153   127.19396    99.70054
    6     5 S   HC   _HA1     6     1.09574   105.19790    82.19791
    7     5 S   CO3  _C1_     7     1.53741   112.28350   -37.99561
    8     7 S   O2Z  _O11     8     1.26369   114.98674   -45.03507
    9     7 S   O2Z  _O12     9     1.26213   114.89934   133.89018
   10     5 S   CT   _CB1    10     1.53062   107.40794  -159.90110
   11    10 S   HC   HB11    11     1.09837   109.27453   -50.12400
   12    10 S   HC   HB12    12     1.09816   110.44491    66.37882
   13    10 S   CT   _CG1    13     1.53085   112.77617  -171.15029
   14    13 S   HC   HG11    14     1.09581   110.62306   -65.80359
   15    13 S   HC   HG12    15     1.09656   109.85151    53.48517
   16    13 S   C    _CD1    16     1.51851   112.02100   173.84585
   17    16 S   O    _OE1    17     1.22792   123.15593     5.98176
   18    16 S   N    _N2_    18     1.38603   111.99870  -174.06528
   19    18 S   H    _HN2    19     1.01560   119.21330     3.37557
   20    18 S   CT1  _CA2    20     1.45793   122.46859   176.93631
   21    20 S   HC   _HA2    21     1.09734   108.76191    27.78389
   22    20 S   C    _C2_    22     1.52981   106.94736   -89.23861
   23    22 S   O    _O2_    23     1.22986   123.02620   -27.81755
   24    20 S   CT   _CB2    32     1.53121   112.74181   151.01485
   25    24 S   HC   HB21    33     1.09600   110.63684    55.64739
   26    24 S   HC   HB22    34     1.09551   109.83727   174.49124
   27    22 S   N    _N3_    24     1.38497   112.60174   154.96559
   28    27 S   H    _HN3    25     1.01661   120.36869    -2.26175
   29    24 S   S    _SG2    35     1.82325   111.67519   -65.21228
   30    27 S   CT   _CA3    26     1.45359   122.45506   178.60142
   31    30 S   HC   HA31    27     1.09569   107.80813   -55.69676
   32    30 S   HC   HA32    28     1.09564   107.60470    60.62755
   33    29 S   CT   _C12    36     1.83019    98.46742  -169.54643
   34    33 S   HC   _H3_    37     1.09486   108.40738    60.14075
   35    33 S   HC   _H4_    38     1.09455   107.01626   -56.36185
   36    30 S   CO3  _C3_    29     1.52886   114.35304  -177.61920
   37    36 S   O2Z  _O31    30     1.26330   116.06835    -0.32746
   38    36 S   O2Z  _O32    31     1.26439   114.40788   179.64009
   39    33 S   CT   _C13    39     1.53143   113.01891  -177.36983
   40    39 S   HC   _H25    40     1.09909   108.10074  -179.78602
   41    39 S   CO3  _C9_    41     1.54395   115.92228   -63.47967
   42    41 S   O2Z  _O34    42     1.26457   115.57254   -26.37619
   43    41 S   O2Z  _O14    43     1.26459   115.68281   156.15270
   44    39 S   OS   _O16    44     1.43733   110.35145    60.81098
   45    44 S   CT   _C10    45     1.43621   114.24256    86.14898
   46    45 S   HC   _H21    46     1.09763   110.28130   -25.69672
   47    45 S   CM   _C6_    47     1.50790   107.57582    92.42091
   48    47 S   HC   _H20    48     1.08589   117.82677   -72.79529
   49    47 S   CM   _C4_    49     1.33915   122.83672   106.44181
   50    49 S   HC   _H18    50     1.08462   120.64188  -179.37193
   51    49 S   CM   _C5_    51     1.44069   121.51714    -1.33969
   52    51 S   HC   _H19    52     1.08551   116.68140  -171.86308
   53    51 S   CM   _C7_    53     1.34192   121.41207     9.27960
   54    45 S   CT   _C11    54     1.55268   107.97391  -144.15859
   55    54 S   HC   _H22    55     1.09724   108.96733    23.51767
   56    53 S   CO3  _C8_    58     1.54224   119.44432   179.25375
   57    56 S   O2Z  _O33    59     1.26633   114.71162  -151.76619
   58    56 S   O2Z  _O13    60     1.26398   116.27729    28.18910
   59    54 S   OH   _O15    56     1.43328   107.97097   139.49889
   60    59 S   HO   _H26    57     0.97501   106.69634  -179.33795
  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   7   5   4   3
   9   5   4   2   1   1   9   5   4   2   1   9  12   7   9   4
   6   3   8   3   7   6   3   3   1   1   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    44  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43    44    45  
   35    39    40    41    44  
   39    40    41    44  
   37    38  
   38  
    0  
   40    41    42    43    44    45    46    47    54  
   41    42    43    44    45  
   42    43    44    45  
   43    44  
   44  
   45    46    47    48    49    53    54    55    59  
   46    47    48    49    50    51    53    54    55    59    60    56  
   47    48    49    53    54    55    59  
   48    49    50    51    52    53    54    55    59  
   49    50    51    54  
   50    51    52    53    54    56  
   51    52    53  
   52    53    54    55    59    56    57    58  
   53    54    56  
   54    55    59    60    56    57    58  
   55    59    60    56    57    58  
   59    60    56  
   57    58    59  
   58  
    0  
   60  
    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   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.3810   1.2100   0.008598240   0.268726247
   41   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   44   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   45   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5500   0.0760  -0.310300   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   57   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   59   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
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   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    44   320.000  1.410
   41    42   656.000  1.250
   41    43   656.000  1.250
   44    45   320.000  1.410
   45    46   340.000  1.090
   45    47   317.000  1.510
   45    54   268.000  1.529
   47    48   340.000  1.080
   47    49   549.000  1.340
   49    50   340.000  1.080
   49    51   380.000  1.444
   51    52   340.000  1.080
   51    53   549.000  1.340
   53    54   317.000  1.510
   53    56   230.000  1.545
   54    55   340.000  1.090
   54    59   320.000  1.410
   59    60   553.000  0.945
   56    57   656.000  1.250
   56    58   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    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    70.00000  109.69300
   33    39    44    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    70.00000  117.00000
   39    41    43    70.00000  117.00000
   39    44    45    60.00000  109.50000
   41    39    40    35.00000  109.50000
   43    41    42    80.00000  126.00000
   44    39    40    35.00000  109.50000
   44    39    41    85.00000  109.63000
   44    45    46    35.00000  109.50000
   44    45    47    85.00000  110.90400
   44    45    54    50.00000  109.50000
   45    47    48    35.00000  117.00000
   45    47    49    70.00000  124.00000
   45    54    53    70.00000  112.02700
   45    54    55    37.50000  110.70000
   45    54    59    50.00000  109.50000
   47    45    46    35.00000  109.50000
   47    49    50    35.00000  120.00000
   47    49    51    70.00000  123.01800
   49    47    48    35.00000  120.00000
   49    51    52    35.00000  120.00000
   49    51    53    70.00000  123.01800
   51    49    50    35.00000  120.00000
   51    53    54    70.00000  124.00000
   51    53    56    55.00000  124.75400
   53    51    52    35.00000  120.00000
   53    54    55    35.00000  109.50000
   53    54    59    90.00000  110.39200
   53    56    57    85.00000  113.83300
   53    56    58    85.00000  113.83300
   54    45    46    37.50000  110.70000
   54    45    47    70.00000  112.02700
   54    59    60    55.00000  108.50000
   59    54    55    35.00000  109.50000
   56    53    54    65.00000  117.04000
   58    56    57    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   0.32350  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   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    39    41    42   0.41150 -1.0 2.0
   33    39    41    43   0.41150 -1.0 2.0
   33    39    44    45   0.06250  1.0 1.0
   33    39    44    45  -0.01100 -1.0 2.0
   33    39    44    45   0.28050  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    44   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    44   0.23400  1.0 3.0
   39    44    45    46   0.37050  1.0 3.0
   39    44    45    47  -0.77900  1.0 1.0
   39    44    45    47  -0.36900 -1.0 2.0
   39    44    45    47   0.40400  1.0 3.0
   39    44    45    54   0.06250  1.0 1.0
   39    44    45    54  -0.01100 -1.0 2.0
   39    44    45    54   0.28050  1.0 3.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    43   0.00000  1.0 1.0
   40    39    44    45   0.37050  1.0 3.0
   41    39    44    45  -1.11000  1.0 1.0
   41    39    44    45   0.50250 -1.0 2.0
   41    39    44    45   0.47450  1.0 3.0
   44    39    41    42   0.30150 -1.0 2.0
   44    39    41    43   0.30150 -1.0 2.0
   44    45    47    48   0.00000  1.0 1.0
   44    45    47    49   0.39000  1.0 1.0
   44    45    47    49  -0.05800 -1.0 2.0
   44    45    47    49  -0.55150  1.0 3.0
   44    45    54    53   0.61850  1.0 1.0
   44    45    54    53  -0.22750 -1.0 2.0
   44    45    54    53   0.15300  1.0 3.0
   44    45    54    55   0.23400  1.0 3.0
   44    45    54    59   3.69350  1.0 1.0
   44    45    54    59  -1.82950 -1.0 2.0
   45    47    49    50   7.00000 -1.0 2.0
   45    47    49    51   7.00000 -1.0 2.0
   45    54    59    60  -0.11600  1.0 1.0
   45    54    59    60  -0.09450 -1.0 2.0
   45    54    59    60   0.21250  1.0 3.0
   46    45    47    48   0.33100  1.0 3.0
   46    45    47    49   0.00000  1.0 1.0
   46    45    54    53   0.15000  1.0 3.0
   46    45    54    55   0.15000  1.0 3.0
   46    45    54    59   0.23400  1.0 3.0
   47    45    54    53   0.31000  1.0 1.0
   47    45    54    53   0.14700 -1.0 2.0
   47    45    54    53   0.07550  1.0 3.0
   47    45    54    55   0.15000  1.0 3.0
   47    45    54    59   1.05650  1.0 1.0
   47    45    54    59   0.15600 -1.0 2.0
   47    45    54    59   0.53150  1.0 3.0
   47    49    51    52  -0.18600  1.0 3.0
   47    49   -51    53   0.28850  1.0 1.0
   47    49   -51    53   2.61350 -1.0 2.0
   47    49   -51    53   0.78400  1.0 3.0
   48    47    49    50   7.00000 -1.0 2.0
   48    47    49    51   7.00000 -1.0 2.0
   49    51    53    54   7.00000 -1.0 2.0
   49    51    53    56   7.00000 -1.0 2.0
   50    49    51    52   0.00000  1.0 1.0
   50    49    51    53  -0.18600  1.0 3.0
   51    53   -54    45   0.09850  1.0 1.0
   51    53   -54    45   0.15250 -1.0 2.0
   51    53   -54    45  -0.50650  1.0 3.0
   51    53    54    55   0.00000  1.0 1.0
   51    53    54    59   0.67800  1.0 1.0
   51    53    54    59   0.47050 -1.0 2.0
   51    53    54    59  -0.62500  1.0 3.0
   51    53    56    57  -0.04000 -1.0 2.0
   51    53    56    57  -0.29050  1.0 3.0
   51    53    56    58  -0.04000 -1.0 2.0
   51    53    56    58  -0.29050  1.0 3.0
   52    51    53    54   7.00000 -1.0 2.0
   52    51    53    56   7.00000 -1.0 2.0
   53    54    59    60  -0.07800  1.0 1.0
   53    54    59    60  -0.21500 -1.0 2.0
   53    54    59    60  -0.03150  1.0 3.0
   54    45    47    48   0.00000  1.0 1.0
   54    45   -47    49   0.09850  1.0 1.0
   54    45   -47    49   0.15250 -1.0 2.0
   54    45   -47    49  -0.50650  1.0 3.0
   54    53    56    57  -0.64400  1.0 1.0
   54    53    56    57   0.26850 -1.0 2.0
   54    53    56    58  -0.64400  1.0 1.0
   54    53    56    58   0.26850 -1.0 2.0
   55    54    59    60   0.19450  1.0 3.0
   56    53    54    45   0.09700  1.0 1.0
   56    53    54    45   0.15600 -1.0 2.0
   56    53    54    45  -0.50800  1.0 3.0
   56    53    54    55   0.15000  1.0 3.0
   56    53    54    59   0.09700  1.0 1.0
   56    53    54    59   0.15600 -1.0 2.0
   56    53    54    59  -0.50800  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
   38    30    36    37  10.50000 -1.0 2.0
   42    39    41    43  10.50000 -1.0 2.0
   45    48    47    49   1.10000 -1.0 2.0
   51    50    49    47   1.10000 -1.0 2.0
   49    52    51    53   1.10000 -1.0 2.0
   56    54    53    51   1.10000 -1.0 2.0
   57    53    56    58  10.50000 -1.0 2.0
END
