* LIGAND DATABASE FILE (OPLS2005)
*
001      59    61    114    182     337
    1     0 S   NP   _N1_     1    30.65018    93.33254   -16.56102
    2     1 S   H    _HN1     2     1.03094   117.54514     2.97901
    3     1 S   H    _H1_     3     1.02949   118.11351   134.82518
    4     1 S   H    _H2_     4     1.02791    21.57523    70.80758
    5     1 S   CT   _CA1     5     1.50101    89.49214  -112.15928
    6     5 S   HC   _HA1     6     1.09558   105.37418    55.44018
    7     5 S   CO3  _C1_     7     1.53730   112.44496   -65.17294
    8     7 S   O2Z  _O11     8     1.26379   115.00364   -45.28553
    9     7 S   O2Z  _O12     9     1.26228   114.95805   134.06071
   10     5 S   CT   _CB1    10     1.52903   107.26318   173.35574
   11    10 S   HC   HB11    11     1.09839   109.31761   -52.36969
   12    10 S   HC   HB12    12     1.09717   110.07578    63.72459
   13    10 S   CT   _CG1    13     1.53120   113.19583  -173.75248
   14    13 S   HC   HG11    14     1.09559   111.26625   -69.13422
   15    13 S   HC   HG12    15     1.09588   110.73607    50.52089
   16    13 S   C    _CD1    16     1.51401   109.85810   169.95367
   17    16 S   O    _OE1    17     1.22816   121.71580  -103.96237
   18    16 S   N    _N2_    18     1.38444   112.82613    73.92811
   19    18 S   H    _HN2    19     1.01588   119.16815     5.82810
   20    18 S   CT1  _CA2    20     1.46216   123.16786  -171.55827
   21    20 S   HC   _HA2    21     1.09722   109.36146   -11.61710
   22    20 S   C    _C2_    22     1.53278   108.82891  -127.78596
   23    22 S   O    _O2_    23     1.23024   122.15900  -146.70563
   24    20 S   CT   _CB2    32     1.53596   111.02479   109.94953
   25    24 S   HC   HB21    33     1.09542   109.45330    60.68799
   26    24 S   HC   HB22    34     1.09561   110.48799   178.64549
   27    22 S   N    _N3_    24     1.38476   113.42931    40.70793
   28    27 S   H    _HN3    25     1.01534   118.93600    -0.56475
   29    24 S   S    _SG2    35     1.82470   111.58080   -61.29370
   30    27 S   CT   _CA3    26     1.45431   123.32285   175.22989
   31    30 S   HC   HA31    27     1.09534   109.07458    27.33753
   32    30 S   HC   HA32    28     1.09492   107.15888   144.30115
   33    29 S   CM   _C9_    36     1.71230   101.22188   163.52654
   34    30 S   CO3  _C3_    29     1.52929   113.24745   -96.03623
   35    34 S   O2Z  _O31    30     1.26392   115.46588   -43.67561
   36    34 S   O2Z  _O32    31     1.26367   114.95030   137.30137
   37    33 S   CM   _C10    37     1.34405   127.91851   -72.73433
   38    37 S   Cl   Cl4_    38     1.69857   128.46881     0.68927
   39    37 S   CT   _C11    39     1.51671   108.02765  -178.72497
   40    39 S   Cl   Cl3_    40     1.75541   116.46767  -158.46458
   41    39 S   CT   _C5_    41     1.57413   108.74514    70.97938
   42    41 S   HC   _H3_    42     1.09989   107.92064  -178.50381
   43    41 S   CT   _C4_    43     1.53367   117.28552    64.29098
   44    43 S   HC   _H5_    44     1.09587   108.95686    56.74978
   45    43 S   HC   _H6_    45     1.09858   110.20057   172.16514
   46    41 S   CT   _C6_    53     1.57721   102.09385   -66.34832
   47    46 S   HC   _H4_    54     1.09997   106.61989  -113.42328
   48    43 S   OS   _O35    46     1.41888   113.95552   -62.05169
   49    33 S   CT   _C8_    55     1.52485   125.75732   109.95457
   50    49 S   Cl   Cl5_    56     1.75730   116.45725   -22.26603
   51    48 S   SZ   _S1_    47     1.60875   115.72088   -92.92435
   52    51 S   OZ   _O34    48     1.50027   107.07913  -171.00833
   53    39 S   CT   _C12    57     1.56200    98.78969   -35.30532
   54    53 S   Cl   Cl1_    58     1.79505   115.05264   172.23838
   55    53 S   Cl   Cl2_    59     1.80700   114.59821   -64.64161
   56    51 S   OS   _O33    49     1.60859    97.90266    78.13944
   57    56 S   CT   _C7_    50     1.41933   115.93464   -78.19413
   58    57 S   HC   _H7_    51     1.09855   111.08152   -32.47133
   59    57 S   HC   _H8_    52     1.09588   106.54742  -147.02468
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   8   5   4   3
  13   2   1   1  12   5  15   8  17   9  11   4   3  12   7   4
   8   4   5   2   3   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    46    49    50    53  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    57    46    47    49    50    53    54    55  
   35    36  
   36  
    0  
   38    39    40    41    42    43    46    49    50    53    54    55  
   39    40    41    49    53  
   40    41    42    43    44    45    48    57    46    47    49    50    53    54    55  
   41    42    43    46    49    53    54    55  
   42    43    44    45    48    51    56    57    58    59    46    47    49    50    53    54    55  
   43    44    45    48    57    46    47    49    53  
   44    45    48    51    52    56    57    46    47    49    53  
   45    48    51    46  
   48    51    46  
   47    49    50    53    54    55    48    51    56    57    58    59  
   49    50    53    56    57    58    59  
   51    52    56    57  
   50    53    54    55    56    57    58    59  
   53    54    55    57  
   52    56    57    58    59  
   56    57  
   54    55    57  
   55  
    0  
   57    58    59  
   58    59  
   59  
    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  -0.175000   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   3.5500   0.0760   0.007500   2.0020   1.7750   0.023028004  -0.852763146
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.120000   2.0020   1.7750   0.023028004  -0.852763146
   38   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   39   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   40   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   41   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660   0.102500   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.9000   0.1400  -0.437500   1.5900   1.4000   0.020110767  -0.896042159
   49   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   51   3.5600   0.3950   0.890000   2.0080   1.7800   0.025682759  -1.666211680
   52   2.7000   0.2800  -0.460000   1.5350   1.3500   0.001000000  -0.126889456
   53   3.5000   0.0660   0.271600   1.9750   1.7500   0.005000000  -0.741685710
   54   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   55   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   56   2.9000   0.1400  -0.437500   1.5900   1.4000   0.020110767  -0.896042159
   57   3.5000   0.0660   0.102500   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   240.000  1.763
   33    37   549.000  1.340
   33    49   317.000  1.510
   37    38   300.000  1.725
   37    39   317.000  1.510
   39    40   245.000  1.781
   39    41   268.000  1.529
   39    53   268.000  1.529
   41    42   340.000  1.090
   41    43   268.000  1.529
   41    46   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    48   320.000  1.410
   48    51   295.000  1.710
   51    52   700.000  1.530
   51    56   295.000  1.710
   56    57   320.000  1.410
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    46   268.000  1.529
   46    47   340.000  1.090
   46    49   268.000  1.529
   49    50   245.000  1.781
   49    53   268.000  1.529
   53    54   245.000  1.781
   53    55   245.000  1.781
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    65.00000  122.11800
   29    33    49    65.00000  117.37300
   33    37    38    75.00000  121.50000
   33    37    39    70.00000  124.00000
   33    49    46    70.00000  112.02700
   33    49    50    75.00000  111.90500
   33    49    53    70.00000  112.02700
   37    39    40    75.00000  111.90500
   37    39    41    70.00000  112.02700
   37    39    53    70.00000  112.02700
   39    37    38    75.00000  111.02000
   39    41    42    37.50000  110.70000
   39    41    43    58.35000  112.70000
   39    41    46    58.35000  112.70000
   39    53    49    58.35000  112.70000
   39    53    54    69.00000  109.80000
   39    53    55    69.00000  109.80000
   41    39    40    69.00000  109.80000
   41    43    44    37.50000  110.70000
   41    43    45    37.50000  110.70000
   41    43    48    50.00000  109.50000
   41    46    57    58.35000  112.70000
   41    46    47    37.50000  110.70000
   41    46    49    58.35000  112.70000
   43    41    42    37.50000  110.70000
   43    48    51   100.00000  113.63300
   45    43    44    33.00000  107.80000
   48    43    44    35.00000  109.50000
   48    43    45    35.00000  109.50000
   48    51    52   130.00000  108.94000
   48    51    56   130.00000  109.00000
   51    56    57   100.00000  113.63300
   56    51    52   130.00000  108.94000
   56    57    58    35.00000  109.50000
   56    57    59    35.00000  109.50000
   56    57    46    50.00000  109.50000
   57    46    47    37.50000  110.70000
   57    46    49    58.35000  112.70000
   59    57    58    33.00000  107.80000
   46    41    42    37.50000  110.70000
   46    41    43    58.35000  112.70000
   46    57    58    37.50000  110.70000
   46    57    59    37.50000  110.70000
   46    49    50    69.00000  109.80000
   46    49    53    58.35000  112.70000
   49    33    37    70.00000  124.00000
   49    46    47    37.50000  110.70000
   49    53    54    69.00000  109.80000
   49    53    55    69.00000  109.80000
   53    39    40    69.00000  109.80000
   53    39    41    58.35000  112.70000
   53    49    50    69.00000  109.80000
   55    53    54    80.00000  110.42200
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   0.00000  1.0 1.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   1.00000 -1.0 2.0
   24    29    33    49   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   7.00000 -1.0 2.0
   29    33    37    39   7.00000 -1.0 2.0
   29    33    49    46   0.09700  1.0 1.0
   29    33    49    46   0.15600 -1.0 2.0
   29    33    49    46  -0.50800  1.0 3.0
   29    33    49    50   0.09700  1.0 1.0
   29    33    49    50   0.15600 -1.0 2.0
   29    33    49    50  -0.50800  1.0 3.0
   29    33    49    53   0.09700  1.0 1.0
   29    33    49    53   0.15600 -1.0 2.0
   29    33    49    53  -0.50800  1.0 3.0
   33    37    39    40   0.09700  1.0 1.0
   33    37    39    40   0.15600 -1.0 2.0
   33    37    39    40  -0.50800  1.0 3.0
   33    37    39    41   0.09850  1.0 1.0
   33    37    39    41   0.15250 -1.0 2.0
   33    37    39    41  -0.50650  1.0 3.0
   33    37   -39    53   0.09850  1.0 1.0
   33    37   -39    53   0.15250 -1.0 2.0
   33    37   -39    53  -0.50650  1.0 3.0
   33    49   -53    39   0.34400  1.0 1.0
   33    49   -53    39   0.09450 -1.0 2.0
   33    49   -53    39   0.11100  1.0 3.0
   33    49    53    54   0.56750  1.0 1.0
   33    49    53    54  -0.07550 -1.0 2.0
   33    49    53    54   0.20000  1.0 3.0
   33    49    53    55   0.56750  1.0 1.0
   33    49    53    55  -0.07550 -1.0 2.0
   33    49    53    55   0.20000  1.0 3.0
   37    33    49    46   0.09850  1.0 1.0
   37    33    49    46   0.15250 -1.0 2.0
   37    33    49    46  -0.50650  1.0 3.0
   37    33    49    50   0.09700  1.0 1.0
   37    33    49    50   0.15600 -1.0 2.0
   37    33    49    50  -0.50800  1.0 3.0
   37    33   -49    53   0.09850  1.0 1.0
   37    33   -49    53   0.15250 -1.0 2.0
   37    33   -49    53  -0.50650  1.0 3.0
   37    39    41    42   0.15000  1.0 3.0
   37    39    41    43   0.34400  1.0 1.0
   37    39    41    43   0.09450 -1.0 2.0
   37    39    41    43   0.11100  1.0 3.0
   37    39   -41    46   0.34400  1.0 1.0
   37    39   -41    46   0.09450 -1.0 2.0
   37    39   -41    46   0.11100  1.0 3.0
   37    39   -53    49   0.34400  1.0 1.0
   37    39   -53    49   0.09450 -1.0 2.0
   37    39   -53    49   0.11100  1.0 3.0
   37    39    53    54   0.56750  1.0 1.0
   37    39    53    54  -0.07550 -1.0 2.0
   37    39    53    54   0.20000  1.0 3.0
   37    39    53    55   0.56750  1.0 1.0
   37    39    53    55  -0.07550 -1.0 2.0
   37    39    53    55   0.20000  1.0 3.0
   38    37    39    40   0.09700  1.0 1.0
   38    37    39    40   0.15600 -1.0 2.0
   38    37    39    40  -0.50800  1.0 3.0
   38    37    39    41   0.09700  1.0 1.0
   38    37    39    41   0.15600 -1.0 2.0
   38    37    39    41  -0.50800  1.0 3.0
   38    37    39    53   0.09700  1.0 1.0
   38    37    39    53   0.15600 -1.0 2.0
   38    37    39    53  -0.50800  1.0 3.0
   39    41    43    44   0.15000  1.0 3.0
   39    41    43    45   0.15000  1.0 3.0
   39    41    43    48   0.62750  1.0 1.0
   39    41    43    48  -0.30950 -1.0 2.0
   39    41    43    48   0.27300  1.0 3.0
   39    41    46    57   0.56750  1.0 1.0
   39    41    46    57  -0.07550 -1.0 2.0
   39    41    46    57   0.20000  1.0 3.0
   39    41    46    47   0.15000  1.0 3.0
   39    41   -46    49   0.56750  1.0 1.0
   39    41   -46    49  -0.07550 -1.0 2.0
   39    41   -46    49   0.20000  1.0 3.0
   40    39    41    42   0.27000  1.0 3.0
   40    39    41    43   0.35600  1.0 1.0
   40    39    41    43  -0.14650 -1.0 2.0
   40    39    41    43   0.33350  1.0 3.0
   40    39    41    46   0.35600  1.0 1.0
   40    39    41    46  -0.14650 -1.0 2.0
   40    39    41    46   0.33350  1.0 3.0
   40    39    53    49   0.35600  1.0 1.0
   40    39    53    49  -0.14650 -1.0 2.0
   40    39    53    49   0.33350  1.0 3.0
   40    39    53    54   0.22500  1.0 1.0
   40    39    53    55   0.22500  1.0 1.0
   41    39   -53    49   0.56750  1.0 1.0
   41    39   -53    49  -0.07550 -1.0 2.0
   41    39   -53    49   0.20000  1.0 3.0
   41    39    53    54   0.35600  1.0 1.0
   41    39    53    54  -0.14650 -1.0 2.0
   41    39    53    54   0.33350  1.0 3.0
   41    39    53    55   0.35600  1.0 1.0
   41    39    53    55  -0.14650 -1.0 2.0
   41    39    53    55   0.33350  1.0 3.0
   41    43    48    51   0.37500  1.0 3.0
   41    46   -49    33   0.34400  1.0 1.0
   41    46   -49    33   0.09450 -1.0 2.0
   41    46   -49    33   0.11100  1.0 3.0
   41    46    49    50   0.35600  1.0 1.0
   41    46    49    50  -0.14650 -1.0 2.0
   41    46    49    50   0.33350  1.0 3.0
   41    46   -49    53   0.56750  1.0 1.0
   41    46   -49    53  -0.07550 -1.0 2.0
   41    46   -49    53   0.20000  1.0 3.0
   42    41    43    44   0.15000  1.0 3.0
   42    41    43    45   0.15000  1.0 3.0
   42    41    43    48   0.23400  1.0 3.0
   42    41    46    57   0.15000  1.0 3.0
   42    41    46    47   0.15000  1.0 3.0
   42    41    46    49   0.15000  1.0 3.0
   43    41    46    57   0.56750  1.0 1.0
   43    41    46    57  -0.07550 -1.0 2.0
   43    41    46    57   0.20000  1.0 3.0
   43    41    46    47   0.15000  1.0 3.0
   43    41    46    49   0.56750  1.0 1.0
   43    41    46    49  -0.07550 -1.0 2.0
   43    41    46    49   0.20000  1.0 3.0
   43    48    51    52   0.00000  1.0 1.0
   43    48    51    56   0.00000  1.0 1.0
   44    43    48    51   0.37500  1.0 3.0
   45    43    48    51   0.37500  1.0 3.0
   48    51    56    57   0.00000  1.0 1.0
   51    56    57    58   0.37500  1.0 3.0
   51    56    57    59   0.37500  1.0 3.0
   51    56    57    46   0.37500  1.0 3.0
   52    51    56    57   0.00000  1.0 1.0
   56    57    46    41   0.62750  1.0 1.0
   56    57    46    41  -0.30950 -1.0 2.0
   56    57    46    41   0.27300  1.0 3.0
   56    57    46    47   0.23400  1.0 3.0
   56    57    46    49   0.62750  1.0 1.0
   56    57    46    49  -0.30950 -1.0 2.0
   56    57    46    49   0.27300  1.0 3.0
   57    46    49    33   0.34400  1.0 1.0
   57    46    49    33   0.09450 -1.0 2.0
   57    46    49    33   0.11100  1.0 3.0
   57    46    49    50   0.35600  1.0 1.0
   57    46    49    50  -0.14650 -1.0 2.0
   57    46    49    50   0.33350  1.0 3.0
   57    46    49    53   0.56750  1.0 1.0
   57    46    49    53  -0.07550 -1.0 2.0
   57    46    49    53   0.20000  1.0 3.0
   58    57    46    41   0.15000  1.0 3.0
   58    57    46    47   0.15000  1.0 3.0
   58    57    46    49   0.15000  1.0 3.0
   59    57    46    41   0.15000  1.0 3.0
   59    57    46    47   0.15000  1.0 3.0
   59    57    46    49   0.15000  1.0 3.0
   46    41    43    44   0.15000  1.0 3.0
   46    41    43    45   0.15000  1.0 3.0
   46    41    43    48   0.62750  1.0 1.0
   46    41    43    48  -0.30950 -1.0 2.0
   46    41    43    48   0.27300  1.0 3.0
   46    49   -53    39   0.56750  1.0 1.0
   46    49   -53    39  -0.07550 -1.0 2.0
   46    49   -53    39   0.20000  1.0 3.0
   46    49    53    54   0.35600  1.0 1.0
   46    49    53    54  -0.14650 -1.0 2.0
   46    49    53    54   0.33350  1.0 3.0
   46    49    53    55   0.35600  1.0 1.0
   46    49    53    55  -0.14650 -1.0 2.0
   46    49    53    55   0.33350  1.0 3.0
   47    46    49    33   0.15000  1.0 3.0
   47    46    49    50   0.27000  1.0 3.0
   47    46    49    53   0.15000  1.0 3.0
   49    33    37    38   7.00000 -1.0 2.0
   49    33   -37    39   7.00000 -1.0 2.0
   50    49    53    39   0.35600  1.0 1.0
   50    49    53    39  -0.14650 -1.0 2.0
   50    49    53    39   0.33350  1.0 3.0
   50    49    53    54   0.22500  1.0 1.0
   50    49    53    55   0.22500  1.0 1.0
   53    39    41    42   0.15000  1.0 3.0
   53    39    41    43   0.56750  1.0 1.0
   53    39    41    43  -0.07550 -1.0 2.0
   53    39    41    43   0.20000  1.0 3.0
   53    39   -41    46   0.56750  1.0 1.0
   53    39   -41    46  -0.07550 -1.0 2.0
   53    39   -41    46   0.20000  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
   35    30    34    36  10.50000 -1.0 2.0
   29    49    33    37   1.10000 -1.0 2.0
   39    38    37    33   1.10000 -1.0 2.0
END
