* LIGAND DATABASE FILE (OPLS2005)
*
001      62    62    115    176     342
    1     0 S   NP   _N1_     1    28.90353    94.18143   -20.29440
    2     1 S   H    _HN1     2     1.02782    84.82714   -80.04190
    3     1 S   H    _H1_     3     1.02956    95.62449    27.87864
    4     1 S   H    _H2_     4     1.02842    31.20797   141.93862
    5     1 S   CT   _CA1     5     1.50108   140.90620   160.61184
    6     5 S   HC   _HA1     6     1.09572   105.27506    49.15827
    7     5 S   CO3  _C1_     7     1.53797   112.13563   -71.13421
    8     7 S   O2Z  _O11     8     1.26363   115.00871   -49.47737
    9     7 S   O2Z  _O12     9     1.26223   114.84627   129.53832
   10     5 S   CT   _CB1    10     1.53057   107.42999   167.04226
   11    10 S   HC   HB11    11     1.09825   109.44210   -50.23845
   12    10 S   HC   HB12    12     1.09831   110.40254    66.31621
   13    10 S   CT   _CG1    13     1.53036   112.66244  -171.31434
   14    13 S   HC   HG11    14     1.09541   110.42604   -60.29509
   15    13 S   HC   HG12    15     1.09624   110.13773    58.94256
   16    13 S   C    _CD1    16     1.51782   111.98414   179.18123
   17    16 S   O    _OE1    17     1.22753   123.11823    -8.29574
   18    16 S   N    _N2_    18     1.38631   111.86821   171.92688
   19    18 S   H    _HN2    19     1.01592   119.13981     1.53174
   20    18 S   CT1  _CA2    20     1.46280   123.13670  -177.77912
   21    20 S   HC   _HA2    21     1.09734   109.27648   -13.80626
   22    20 S   C    _C2_    22     1.53369   108.55515  -129.58319
   23    22 S   O    _O2_    23     1.23013   122.18383  -146.62672
   24    20 S   CT   _CB2    32     1.53466   111.48031   108.05322
   25    24 S   HC   HB21    33     1.09437   109.78584    59.59377
   26    24 S   HC   HB22    34     1.09536   110.48469   177.46549
   27    22 S   N    _N3_    24     1.38490   113.37856    40.74852
   28    27 S   H    _HN3    25     1.01530   118.91216    -0.64921
   29    24 S   S    _SG2    35     1.82918   111.62304   -63.45568
   30    27 S   CT   _CA3    26     1.45459   123.50671   175.08801
   31    30 S   HC   HA31    27     1.09518   109.31138    22.80414
   32    30 S   HC   HA32    28     1.09497   107.10011   139.82748
   33    29 S   CT   _C8_    36     1.85242   100.41888   144.40993
   34    33 S   HC   _H3_    37     1.09645   105.76137    40.86085
   35    30 S   CO3  _C3_    29     1.52925   113.07857  -100.72165
   36    35 S   O2Z  _O31    30     1.26405   115.39433   -44.32320
   37    35 S   O2Z  _O32    31     1.26353   114.98742   136.60133
   38    33 S   CT   _C9_    38     1.54269   109.58505   -75.30929
   39    38 S   HC   _H10    39     1.09688   110.34730    52.95486
   40    38 S   HC   _H11    40     1.09680   109.06502   167.36185
   41    38 S   CT   _C10    41     1.53403   113.12053   -69.86727
   42    41 S   Cl   Cl1_    42     1.80023   108.82747   177.47516
   43    41 S   HC   _H4_    43     1.09556   108.36619    65.00620
   44    41 S   CT   _C5_    44     1.55906   113.64181   -56.15939
   45    44 S   CT   _C6_    45     1.56317   109.33148    48.89763
   46    45 S   HC   _H8_    46     1.10013   107.30490    75.16958
   47    45 S   HC   _H9_    47     1.10015   109.20137  -171.82514
   48    44 S   CM   _C12    54     1.53107   111.58265   -73.18440
   49    48 S   HC   _H14    55     1.08809   116.20136    38.66940
   50    44 S   CT   _C4_    59     1.55401   108.09489   164.91733
   51    50 S   HC   _H5_    60     1.09667   111.11199   -51.87238
   52    50 S   HC   _H6_    61     1.09639   111.56652  -170.82746
   53    50 S   HC   _H7_    62     1.09575   112.05491    68.15336
   54    33 S   CT   _C7_    48     1.56069   112.33334   159.69967
   55    54 S   Cl   Cl2_    49     1.82181   108.31164  -166.01528
   56    48 S   CM   _C13    56     1.33803   127.04253  -140.28838
   57    56 S   Cl   Cl3_    57     1.71510   122.65528   179.58175
   58    56 S   HC   _H15    58     1.08049   125.51372    -0.84904
   59    54 S   CT   _C11    50     1.54797   115.31479   -47.29078
   60    59 S   Br   Br1_    51     1.95222   114.21546   -54.58041
   61    59 S   HC   _H12    52     1.09606   111.39943  -173.71896
   62    59 S   HC   _H13    53     1.09400   112.66200    65.91173
  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
  17   8   2   1   1  12   6   5  14   5   4  15  15   6   5   9
   4   5   2   1   1   5   4   2   1   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    54    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    45    54    55    59  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    46    47    54    55    59    60    61    62  
   38    39    40    41    45    54    55    59  
   36    37  
   37  
    0  
   39    40    41    42    43    44    45    54    55    59    48    50  
   40    41    42    43    44    54  
   41    42    43    44    54  
   42    43    44    45    46    47    54    48    49    56    50    51    52    53  
   43    44    45    48    50  
   44    45    48    50  
   45    46    47    54    55    59    48    49    56    57    58    50    51    52    53  
   46    47    54    55    59    60    61    62    48    49    56    50    51    52    53  
   47    54    55    59    48    50  
   54    55    59    48    50  
   49    56    57    58    50    51    52    53    54  
   56    57    58    50  
   51    52    53    54    56  
   52    53  
   53  
    0  
   55    59    60    61    62  
   59    60    61    62  
   57    58  
   58  
    0  
   60    61    62  
   61    62  
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   42   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   43   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.180000   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   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   55   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   56   3.5500   0.0760   0.005000   2.0020   1.7750   0.023028004  -0.852763146
   57   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.088900   1.9750   1.7500   0.005000000  -0.741685710
   60   3.4700   0.4700  -0.203900   2.8000   2.5000   0.001000000  -0.686339560
   61   2.5000   0.0300   0.146400   1.4250   1.2500   0.008598240   0.268726247
   62   2.5000   0.0300   0.146400   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    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   268.000  1.529
   33    54   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   268.000  1.529
   41    42   245.000  1.781
   41    43   340.000  1.090
   41    44   268.000  1.529
   44    45   268.000  1.529
   44    48   317.000  1.510
   44    50   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    54   268.000  1.529
   54    55   245.000  1.781
   54    59   268.000  1.529
   59    60   245.000  1.990
   59    61   340.000  1.090
   59    62   340.000  1.090
   48    49   340.000  1.080
   48    56   549.000  1.340
   56    57   300.000  1.725
   56    58   340.000  1.080
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   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    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  111.63000
   29    33    54    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    54    45    58.35000  112.70000
   33    54    55    69.00000  109.80000
   33    54    59    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    41    42    69.00000  109.80000
   38    41    43    37.50000  110.70000
   38    41    44    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    37.50000  110.70000
   41    38    40    37.50000  110.70000
   41    44    45    58.35000  112.70000
   41    44    48    70.00000  112.02700
   41    44    50    58.35000  112.70000
   43    41    42    51.00000  107.60000
   44    41    42    69.00000  109.80000
   44    41    43    37.50000  110.70000
   44    45    46    37.50000  110.70000
   44    45    47    37.50000  110.70000
   44    45    54    58.35000  112.70000
   44    48    49    35.00000  117.00000
   44    48    56    70.00000  124.00000
   44    50    51    37.50000  110.70000
   44    50    52    37.50000  110.70000
   44    50    53    37.50000  110.70000
   45    54    55    69.00000  109.80000
   45    54    59    58.35000  112.70000
   47    45    46    33.00000  107.80000
   54    33    34    37.50000  110.70000
   54    33    38    58.35000  112.70000
   54    45    46    37.50000  110.70000
   54    45    47    37.50000  110.70000
   54    59    60    70.00000  109.17700
   54    59    61    37.50000  110.70000
   54    59    62    37.50000  110.70000
   59    54    55    69.00000  109.80000
   61    59    60    51.00000  107.60000
   62    59    60    51.00000  107.60000
   62    59    61    33.00000  107.80000
   48    44    45    70.00000  112.02700
   48    56    57    75.00000  121.50000
   48    56    58    35.00000  120.00000
   56    48    49    35.00000  120.00000
   58    56    57    60.00000  114.00000
   50    44    45    58.35000  112.70000
   50    44    48    70.00000  112.02700
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    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    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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    54   0.01700  1.0 1.0
   24    29    33    54  -0.23550 -1.0 2.0
   24    29    33    54   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    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33    54    45   0.44750  1.0 1.0
   29    33    54    45  -0.17800 -1.0 2.0
   29    33    54    45   0.20200  1.0 3.0
   29    33    54    55   0.56750  1.0 1.0
   29    33    54    55  -0.07550 -1.0 2.0
   29    33    54    55   0.20000  1.0 3.0
   29    33    54    59   0.44750  1.0 1.0
   29    33    54    59  -0.17800 -1.0 2.0
   29    33    54    59   0.20200  1.0 3.0
   33    38    41    42   0.35600  1.0 1.0
   33    38    41    42  -0.14650 -1.0 2.0
   33    38    41    42   0.33350  1.0 3.0
   33    38    41    43   0.15000  1.0 3.0
   33    38    41    44   0.56750  1.0 1.0
   33    38    41    44  -0.07550 -1.0 2.0
   33    38    41    44   0.20000  1.0 3.0
   33    54    59    60   0.74700  1.0 1.0
   33    54    59    60  -0.19600 -1.0 2.0
   33    54    59    60   0.19200  1.0 3.0
   33    54    59    61   0.15000  1.0 3.0
   33    54    59    62   0.15000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    54    45   0.15000  1.0 3.0
   34    33    54    55   0.27000  1.0 3.0
   34    33    54    59   0.15000  1.0 3.0
   38    33    54    45   0.56750  1.0 1.0
   38    33    54    45  -0.07550 -1.0 2.0
   38    33    54    45   0.20000  1.0 3.0
   38    33    54    55   0.35600  1.0 1.0
   38    33    54    55  -0.14650 -1.0 2.0
   38    33    54    55   0.33350  1.0 3.0
   38    33    54    59   0.56750  1.0 1.0
   38    33    54    59  -0.07550 -1.0 2.0
   38    33    54    59   0.20000  1.0 3.0
   38    41   -44    45   0.56750  1.0 1.0
   38    41   -44    45  -0.07550 -1.0 2.0
   38    41   -44    45   0.20000  1.0 3.0
   38    41    44    48   0.34400  1.0 1.0
   38    41    44    48   0.09450 -1.0 2.0
   38    41    44    48   0.11100  1.0 3.0
   38    41    44    50   0.56750  1.0 1.0
   38    41    44    50  -0.07550 -1.0 2.0
   38    41    44    50   0.20000  1.0 3.0
   39    38    41    42   0.27000  1.0 3.0
   39    38    41    43   0.15000  1.0 3.0
   39    38    41    44   0.15000  1.0 3.0
   40    38    41    42   0.27000  1.0 3.0
   40    38    41    43   0.15000  1.0 3.0
   40    38    41    44   0.15000  1.0 3.0
   41    44    45    46   0.15000  1.0 3.0
   41    44    45    47   0.15000  1.0 3.0
   41    44    45    54   0.56750  1.0 1.0
   41    44    45    54  -0.07550 -1.0 2.0
   41    44    45    54   0.20000  1.0 3.0
   41    44    48    49   0.00000  1.0 1.0
   41    44    48    56   0.09850  1.0 1.0
   41    44    48    56   0.15250 -1.0 2.0
   41    44    48    56  -0.50650  1.0 3.0
   41    44    50    51   0.15000  1.0 3.0
   41    44    50    52   0.15000  1.0 3.0
   41    44    50    53   0.15000  1.0 3.0
   42    41    44    45   0.35600  1.0 1.0
   42    41    44    45  -0.14650 -1.0 2.0
   42    41    44    45   0.33350  1.0 3.0
   42    41    44    48   0.56750  1.0 1.0
   42    41    44    48  -0.07550 -1.0 2.0
   42    41    44    48   0.20000  1.0 3.0
   42    41    44    50   0.35600  1.0 1.0
   42    41    44    50  -0.14650 -1.0 2.0
   42    41    44    50   0.33350  1.0 3.0
   43    41    44    45   0.15000  1.0 3.0
   43    41    44    48   0.15000  1.0 3.0
   43    41    44    50   0.15000  1.0 3.0
   44    45   -54    33   0.56750  1.0 1.0
   44    45   -54    33  -0.07550 -1.0 2.0
   44    45   -54    33   0.20000  1.0 3.0
   44    45    54    55   0.35600  1.0 1.0
   44    45    54    55  -0.14650 -1.0 2.0
   44    45    54    55   0.33350  1.0 3.0
   44    45    54    59   0.56750  1.0 1.0
   44    45    54    59  -0.07550 -1.0 2.0
   44    45    54    59   0.20000  1.0 3.0
   44    48    56    57   7.00000 -1.0 2.0
   44    48    56    58   7.00000 -1.0 2.0
   45    44    48    49   0.00000  1.0 1.0
   45    44    48    56   0.09850  1.0 1.0
   45    44    48    56   0.15250 -1.0 2.0
   45    44    48    56  -0.50650  1.0 3.0
   45    44    50    51   0.15000  1.0 3.0
   45    44    50    52   0.15000  1.0 3.0
   45    44    50    53   0.15000  1.0 3.0
   45    54    59    60   0.74700  1.0 1.0
   45    54    59    60  -0.19600 -1.0 2.0
   45    54    59    60   0.19200  1.0 3.0
   45    54    59    61   0.15000  1.0 3.0
   45    54    59    62   0.15000  1.0 3.0
   46    45    54    33   0.15000  1.0 3.0
   46    45    54    55   0.27000  1.0 3.0
   46    45    54    59   0.15000  1.0 3.0
   47    45    54    33   0.15000  1.0 3.0
   47    45    54    55   0.27000  1.0 3.0
   47    45    54    59   0.15000  1.0 3.0
   54    33    38    39   0.15000  1.0 3.0
   54    33    38    40   0.15000  1.0 3.0
   54    33   -38    41   0.56750  1.0 1.0
   54    33   -38    41  -0.07550 -1.0 2.0
   54    33   -38    41   0.20000  1.0 3.0
   55    54    59    60   0.56750  1.0 1.0
   55    54    59    60  -0.07550 -1.0 2.0
   55    54    59    60   0.20000  1.0 3.0
   55    54    59    61   0.27000  1.0 3.0
   55    54    59    62   0.27000  1.0 3.0
   48    44    45    46   0.15000  1.0 3.0
   48    44    45    47   0.15000  1.0 3.0
   48    44    45    54   0.34400  1.0 1.0
   48    44    45    54   0.09450 -1.0 2.0
   48    44    45    54   0.11100  1.0 3.0
   48    44    50    51   0.15000  1.0 3.0
   48    44    50    52   0.15000  1.0 3.0
   48    44    50    53   0.15000  1.0 3.0
   49    48    56    57   7.00000 -1.0 2.0
   49    48    56    58   7.00000 -1.0 2.0
   50    44    45    46   0.15000  1.0 3.0
   50    44    45    47   0.15000  1.0 3.0
   50    44    45    54   0.56750  1.0 1.0
   50    44    45    54  -0.07550 -1.0 2.0
   50    44    45    54   0.20000  1.0 3.0
   50    44    48    49   0.00000  1.0 1.0
   50    44    48    56   0.09850  1.0 1.0
   50    44    48    56   0.15250 -1.0 2.0
   50    44    48    56  -0.50650  1.0 3.0
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
   36    30    35    37  10.50000 -1.0 2.0
   44    49    48    56  15.00000 -1.0 2.0
   57    58    56    48  15.00000 -1.0 2.0
END
