* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    106    163     315
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02077    33.22550   176.57589
    3     1 S   H    _H1_     3     1.02160    93.26643   -63.57969
    4     1 S   H    _H2_     4     1.02062    87.07545    44.97854
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04724   118.98282     8.58904
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08448   106.40438   -11.12153
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08733   110.25787    59.12705
   26    24 S   HC   HB22    34     1.08755   109.66015   178.75008
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C11    36     1.82473    98.16171  -178.22337
   34    33 S   HC   _H3_    37     1.09429   106.53908   -35.94210
   35    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   36    35 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   37    35 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   38    33 S   CM   _C4_    38     1.50441   109.20021    79.96295
   39    38 S   HC   _H18    39     1.08799   117.76062   -65.08082
   40    38 S   CM   _C5_    40     1.34088   123.72285   117.42193
   41    40 S   HC   _H19    41     1.08702   119.09174   177.44948
   42    40 S   CT   _C12    42     1.50279   123.35445    -2.64308
   43    42 S   HC   _H23    43     1.09754   108.83906  -137.87031
   44    42 S   CT   _C13    44     1.54606   114.39311   -14.80200
   45    44 S   HC   _H24    45     1.09654   108.38253   158.61265
   46    42 S   OS   _O16    54     1.42941   108.66484   106.59336
   47    33 S   CM   _C6_    46     1.51711   110.47745  -155.23500
   48    44 S   NT   _N11    51     1.46746   109.50662   -85.36744
   49    48 S   H    _H25    52     0.99257   117.67356   -33.77711
   50    48 S   H    _H26    53     0.99358   117.64955   159.53932
   51    46 S   CM   _C9_    55     1.32357   114.76630    80.03842
   52    47 S   CMA  _C8_    47     1.34265   121.16745    95.49240
   53    52 S   OM   _O33    48     1.26571   126.22910   180.00000
   54    51 S   CM   _C7_    56     1.34070   121.72238    59.95546
   55    54 S   HC   _H20    57     1.08343   123.02494     0.04846
   56    54 S   HC   _H21    58     1.08623   120.58565   180.00000
   57    51 S   C    _C10    59     1.48060   115.79636  -119.98539
   58    57 S   O    _O13    60     1.22276   123.31083  -179.96044
   59    52 S   OH   _O14    49     1.40699   111.74502    -0.01978
   60    59 S   HO   _H27    50     0.97368   105.50205   180.00000
   61    57 S   OH   _O15    61     1.35236   112.86492    -0.02798
   62    61 S   HO   _H28    62     0.98169   111.95645   179.98022
  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   8   5   4   3
  13   6   2   1   1   9   4   9   4  12   6  10   6   9   7   3
   1   1   7   3   2   5   2   1   3   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    47    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    44    47    52  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    44    45    47    52    53    59    48  
   38    39    40    44    47    52  
   36    37  
   37  
    0  
   39    40    41    42    43    44    47    52    46  
   40    41    42    47  
   41    42    43    44    45    47    48    46    51  
   42    43    44    46  
   43    44    45    47    52    48    49    50    46    51    54    57  
   44    45    47    48    46    51  
   45    47    52    53    59    48    49    50    46    51  
   47    52    48    49    50    46  
   51    54    55    56    57    58    61    47    48  
   52    53    59    60    48    49    50  
   49    50    52  
   50  
    0  
   54    55    56    57    58    61    62  
   53    59    60  
   59    60  
   55    56    57    58    61  
   56    57  
   57  
   58    61    62  
   61    62  
   60  
    0  
   62  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5500   0.0760  -0.184000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5000   0.0660   0.239000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.120000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.8500   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   47   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   48   3.3000   0.1700  -0.900000   1.8650   1.6500   0.051222218  -2.220205820
   49   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   50   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.5500   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   52   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   53   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   54   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   55   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   59   3.0700   0.1700  -0.840200   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   61   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   62   0.5000   0.0300   0.450000   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    38   317.000  1.510
   33    47   317.000  1.510
   38    39   340.000  1.080
   38    40   549.000  1.340
   40    41   340.000  1.080
   40    42   317.000  1.510
   42    43   340.000  1.090
   42    44   268.000  1.529
   42    46   320.000  1.410
   44    45   340.000  1.090
   44    47   317.000  1.510
   44    48   382.000  1.448
   47    52   465.000  1.376
   52    53   745.000  1.250
   52    59   510.000  1.338
   59    60   553.000  0.945
   48    49   434.000  1.010
   48    50   434.000  1.010
   46    51   440.000  1.360
   51    54   549.000  1.340
   51    57   410.000  1.444
   54    55   340.000  1.080
   54    56   340.000  1.080
   57    58   570.000  1.229
   57    61   450.000  1.364
   61    62   553.000  0.945
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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    38    75.00000  112.20000
   29    33    47    75.00000  112.20000
   33    38    39    35.00000  117.00000
   33    38    40    70.00000  124.00000
   33    47    44    65.00000  117.92700
   33    47    52    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    40    41    35.00000  120.00000
   38    40    42    70.00000  124.00000
   40    38    39    35.00000  120.00000
   40    42    43    35.00000  109.50000
   40    42    44    70.00000  112.02700
   40    42    46    85.00000  110.90400
   42    40    41    35.00000  117.00000
   42    44    45    37.50000  110.70000
   42    44    47    70.00000  112.02700
   42    44    48    56.20000  109.47000
   42    46    51    90.00000  111.18400
   44    42    43    37.50000  110.70000
   44    47    52    70.00000  124.00000
   44    48    49    35.00000  109.50000
   44    48    50    35.00000  109.50000
   47    33    34    35.00000  109.50000
   47    33    38    70.00000  110.12100
   47    44    45    35.00000  109.50000
   47    52    53    65.00000  137.10300
   47    52    59    80.00000  121.38400
   52    59    60    70.00000  107.45700
   59    52    53   115.00000  116.36000
   48    44    45    35.00000  109.50000
   48    44    47    75.00000  110.70900
   50    48    49    43.60000  106.40000
   46    42    43    35.00000  109.50000
   46    42    44    50.00000  109.50000
   46    51    54    80.00000  120.01400
   46    51    57    80.00000  119.00000
   51    54    55    35.00000  120.00000
   51    54    56    35.00000  120.00000
   51    57    58    80.00000  125.30000
   51    57    61    90.00000  111.55000
   56    54    55    35.00000  117.00000
   57    51    54    70.00000  118.70000
   57    61    62    35.00000  113.00000
   61    57    58   100.00000  123.32000
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    47  -0.62250  1.0 1.0
   24    29    33    47  -0.38450 -1.0 2.0
   24    29    33    47   0.81900  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    38    39   0.00000  1.0 1.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    47    44   0.30250  1.0 1.0
   29    33    47    44  -0.14950 -1.0 2.0
   29    33    47    44   0.36900  1.0 3.0
   29    33    47    52   0.42700  1.0 1.0
   29    33    47    52  -0.70350 -1.0 2.0
   29    33    47    52  -0.43150  1.0 3.0
   33    38    40    41   7.00000 -1.0 2.0
   33    38    40    42   7.00000 -1.0 2.0
   33    47    52    53   7.00000 -1.0 2.0
   33    47    52    59   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    47    44   0.34800  1.0 3.0
   34    33    47    52   0.00000  1.0 1.0
   38    33    47    44   0.09700  1.0 1.0
   38    33    47    44   0.15600 -1.0 2.0
   38    33    47    44  -0.50800  1.0 3.0
   38    33    47    52  -0.28300  1.0 1.0
   38    33    47    52   0.26700 -1.0 2.0
   38    33    47    52  -0.63300  1.0 3.0
   38    40    42    43   0.00000  1.0 1.0
   38    40   -42    44   0.09850  1.0 1.0
   38    40   -42    44   0.15250 -1.0 2.0
   38    40   -42    44  -0.50650  1.0 3.0
   38    40    42    46   0.39000  1.0 1.0
   38    40    42    46  -0.05800 -1.0 2.0
   38    40    42    46  -0.55150  1.0 3.0
   39    38    40    41   7.00000 -1.0 2.0
   39    38    40    42   7.00000 -1.0 2.0
   40    42    44    45   0.15000  1.0 3.0
   40    42    44    47   0.31000  1.0 1.0
   40    42    44    47   0.14700 -1.0 2.0
   40    42    44    47   0.07550  1.0 3.0
   40    42    44    48   0.59950  1.0 1.0
   40    42    44    48  -0.21400 -1.0 2.0
   40    42    44    48   0.56200  1.0 3.0
   40    42    46    51  -0.48150  1.0 1.0
   40    42    46    51   0.09250 -1.0 2.0
   40    42    46    51  -0.12850  1.0 3.0
   41    40    42    43   0.33100  1.0 3.0
   41    40    42    44   0.00000  1.0 1.0
   41    40    42    46   0.00000  1.0 1.0
   42    44   -47    33   0.46850  1.0 1.0
   42    44   -47    33   0.08550 -1.0 2.0
   42    44   -47    33   0.09800  1.0 3.0
   42    44    47    52   0.09850  1.0 1.0
   42    44    47    52   0.15250 -1.0 2.0
   42    44    47    52  -0.50650  1.0 3.0
   42    44    48    49  -0.05950  1.0 1.0
   42    44    48    49   0.08850 -1.0 2.0
   42    44    48    49   0.11750  1.0 3.0
   42    44    48    50  -0.05950  1.0 1.0
   42    44    48    50   0.08850 -1.0 2.0
   42    44    48    50   0.11750  1.0 3.0
   42    46    51    54  -2.26850  1.0 1.0
   42    46    51    54   3.39050 -1.0 2.0
   42    46    51    57   0.15100 -1.0 2.0
   43    42    44    45   0.15000  1.0 3.0
   43    42    44    47   0.15000  1.0 3.0
   43    42    44    48   0.15000  1.0 3.0
   43    42    46    51   0.08050  1.0 3.0
   44    42    46    51  -0.46850  1.0 1.0
   44    42    46    51   0.09300 -1.0 2.0
   44    42    46    51  -0.12850  1.0 3.0
   44    47    52    53   7.00000 -1.0 2.0
   44    47    52    59   7.00000 -1.0 2.0
   45    44    47    33   0.34800  1.0 3.0
   45    44    47    52   0.00000  1.0 1.0
   45    44    48    49   0.20000  1.0 3.0
   45    44    48    50   0.20000  1.0 3.0
   47    33    38    39   0.00000  1.0 1.0
   47    33   -38    40  -0.28300  1.0 1.0
   47    33   -38    40   0.26700 -1.0 2.0
   47    33   -38    40  -0.63300  1.0 3.0
   47    44    48    49   0.12450  1.0 1.0
   47    44    48    49  -0.40750 -1.0 2.0
   47    44    48    49   0.30300  1.0 3.0
   47    44    48    50   0.12450  1.0 1.0
   47    44    48    50  -0.40750 -1.0 2.0
   47    44    48    50   0.30300  1.0 3.0
   47    52    59    60  -0.66100  1.0 1.0
   47    52    59    60   1.20850 -1.0 2.0
   47    52    59    60  -0.36000  1.0 3.0
   53    52    59    60   2.00000 -1.0 2.0
   48    44    47    33   0.52100  1.0 1.0
   48    44    47    33  -0.20350 -1.0 2.0
   48    44    47    33   0.29750  1.0 3.0
   48    44    47    52   0.90200  1.0 1.0
   48    44    47    52   0.57900 -1.0 2.0
   48    44    47    52  -0.62100  1.0 3.0
   46    42    44    45   0.23400  1.0 3.0
   46    42    44    47   0.61850  1.0 1.0
   46    42    44    47  -0.22750 -1.0 2.0
   46    42    44    47   0.15300  1.0 3.0
   46    42    44    48   1.74050  1.0 1.0
   46    51    54    55   7.00000 -1.0 2.0
   46    51    54    56   7.00000 -1.0 2.0
   46    51    57    58  -0.11900  1.0 1.0
   46    51    57    58   0.76850 -1.0 2.0
   46    51    57    58   0.14100  1.0 3.0
   46    51    57    61   1.50000 -1.0 2.0
   51    57    61    62   1.22000  1.0 1.0
   51    57    61    62   0.17300 -1.0 2.0
   54    51    57    58   1.00000 -1.0 2.0
   54    51    57    61  -0.01000  1.0 1.0
   54    51    57    61   1.29850 -1.0 2.0
   54    51    57    61  -0.09550  1.0 3.0
   57    51    54    55   7.00000 -1.0 2.0
   57    51    54    56   7.00000 -1.0 2.0
   58    57    61    62   0.92200  1.0 1.0
   58    57    61    62   3.74100 -1.0 2.0
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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   42    41    40    38   1.10000 -1.0 2.0
   33    44    47    52   1.10000 -1.0 2.0
   53    59    52    47   1.10000 -1.0 2.0
   46    57    51    54  15.00000 -1.0 2.0
   55    56    54    51  15.00000 -1.0 2.0
   51    61    57    58  10.50000 -1.0 2.0
END
