* LIGAND DATABASE FILE (OPLS2005)
*
001      72    74    130    209     385
    1     0 S   NP   _N1_     1    28.72403    94.41943   -24.79067
    2     1 S   H    _HN1     2     1.02779   114.43251  -105.21011
    3     1 S   H    _H1_     3     1.02957    85.22780     2.77001
    4     1 S   H    _H2_     4     1.02835    21.91341   177.79620
    5     1 S   CT   _CA1     5     1.50129   122.12156   113.89890
    6     5 S   HC   _HA1     6     1.09574   105.21609    80.16549
    7     5 S   CO3  _C1_     7     1.53778   112.35748   -40.03568
    8     7 S   O2Z  _O11     8     1.26365   114.99565   -44.22009
    9     7 S   O2Z  _O12     9     1.26234   114.93256   134.85659
   10     5 S   CT   _CB1    10     1.53087   107.41676  -161.92807
   11    10 S   HC   HB11    11     1.09828   109.32605   -50.50580
   12    10 S   HC   HB12    12     1.09816   110.43320    66.04544
   13    10 S   CT   _CG1    13     1.53021   112.67493  -171.56923
   14    13 S   HC   HG11    14     1.09593   110.50947   -64.56153
   15    13 S   HC   HG12    15     1.09657   109.90796    54.65107
   16    13 S   C    _CD1    16     1.51834   112.27730   175.02114
   17    16 S   O    _OE1    17     1.22753   123.24750     1.18002
   18    16 S   N    _N2_    18     1.38549   111.71902  -178.87152
   19    18 S   H    _HN2    19     1.01554   119.11182     4.27141
   20    18 S   CT1  _CA2    20     1.45816   122.82730   177.73385
   21    20 S   HC   _HA2    21     1.09675   108.99063    23.49982
   22    20 S   C    _C2_    22     1.52746   106.40274   -94.06758
   23    22 S   O    _O2_    23     1.23030   122.54764   -39.92230
   24    20 S   CT   _CB2    32     1.53138   112.24352   146.87839
   25    24 S   HC   HB21    33     1.09606   110.47841    50.08203
   26    24 S   HC   HB22    34     1.09276   109.61647   167.86363
   27    22 S   N    _N3_    24     1.38507   112.88513   142.25564
   28    27 S   H    _HN3    25     1.01604   120.07394    -0.57232
   29    24 S   S    _SG2    35     1.83036   110.55133   -69.12174
   30    27 S   CT   _CA3    26     1.45422   122.44608   178.16006
   31    30 S   HC   HA31    27     1.09564   106.73186   -79.01373
   32    30 S   HC   HA32    28     1.09545   108.98036    37.29608
   33    29 S   CT   _C12    36     1.86705   102.05197  -136.11370
   34    33 S   OM   _O39    37     1.32252   108.23484   168.42405
   35    30 S   CO3  _C3_    29     1.52814   113.99707   159.07278
   36    35 S   O2Z  _O31    30     1.26340   115.75463   -34.99756
   37    35 S   O2Z  _O32    31     1.26418   114.75267   145.53550
   38    33 S   CT   _C13    38     1.57421   108.07008   -76.84368
   39    38 S   HC   _H3_    39     1.10088   109.90320   -56.96074
   40    33 S   OS   _O33    57     1.44776   115.04465    41.22720
   41    38 S   CT   _C14    40     1.54574   115.31179   179.02884
   42    41 S   HC   _H4_    41     1.09546   113.14568   -30.06350
   43    40 S   C5B  _C10    58     1.35921   120.45456    52.49011
   44    41 S   CT   _C15    42     1.51488   101.78913  -148.72916
   45    44 S   HC   _H5_    43     1.09753   109.99979   -77.78558
   46    41 S   OH   _O38    55     1.42066   113.38433    92.66237
   47    46 S   HO   _H17    56     0.97186   108.42277    40.87650
   48    43 S   C5A  _C11    59     1.37686   129.37242    23.78775
   49    48 S   HA   _H10    60     1.08054   132.59616    -0.25411
   50    44 S   CO   _C16    44     1.52147   101.08115    40.20796
   51    44 S   OH   _O37    53     1.41521   112.87405   161.41781
   52    51 S   HO   _H16    54     0.97296   107.13702    51.14754
   53    48 S   NA   _N4_    61     1.37095   107.74961  -179.87180
   54    53 S   H    _H11    62     1.01041   124.85793   179.31872
   55    38 S   OS   _O34    45     1.45389   110.89620    59.67487
   56    50 S   CT   _C17    46     1.52609   112.66255  -160.60916
   57    56 S   HC   _H12    47     1.09463   111.15071    61.48987
   58    56 S   HC   _H13    48     1.09456   111.04163   -61.10305
   59    50 S   OH   _O36    51     1.42833   110.12051    76.78570
   60    59 S   HO   _H15    52     0.97291   106.60999   164.53715
   61    53 S   C56A _C7_    63     1.37573   110.32817    -1.07629
   62    56 S   OH   _O35    49     1.42679   109.30491  -179.62518
   63    62 S   HO   _H14    50     0.97246   107.00448  -178.27308
   64    61 S   CA   _C6_    64     1.39907   130.24760  -179.85873
   65    64 S   HA   _H8_    65     1.08474   121.53903    -0.34207
   66    64 S   CA   _C5_    66     1.39781   117.54832  -179.87180
   67    66 S   HA   _H7_    67     1.08719   119.39741   179.31300
   68    66 S   CA   _C4_    68     1.39311   121.08473     0.06561
   69    68 S   HA   _H6_    69     1.08675   119.69904   179.39187
   70    68 S   CA   _C9_    70     1.39874   120.69452    -0.08393
   71    70 S   HA   _H9_    71     1.08609   120.12175   179.62310
   72    43 S   C56B _C8_    72     1.42466   122.91135  -157.72545
  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  14   7   9  11   7  10  13   7   4   1   7
   4  10   4   1   7   3   6   6   4   3   2   1   8   1   1   7
   4   6   3   4   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    55    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    44    50    55    46    40    43    48    72  
   38    39    41    55    40    43  
   36    37  
   37  
    0  
   39    41    42    44    45    50    55    56    59    51    46    47    40    43  
   41    42    44    50    55    46    40  
   43    48    49    53    61    70    72    41    55  
   42    44    45    50    55    56    59    51    52    46    47  
   44    45    50    55    51    46    47  
   48    49    53    54    61    64    68    70    71    72  
   45    50    55    56    57    58    62    59    60    51    52    46    47  
   50    55    56    59    51    52    46  
   47    50    51    55  
    0  
   49    53    54    61    64    70    72  
   53    54    61    72  
   55    56    57    58    62    63    59    60    51    52  
   52    55    56    59  
    0  
   54    61    64    65    66    70    72  
   61    64    72  
   56    57    58    62    59    60  
   57    58    62    63    59    60  
   58    62    63    59  
   62    63    59  
   60    62  
    0  
   64    65    66    67    68    70    71    72  
   63  
    0  
   65    66    67    68    69    70    72  
   66    67    68    72  
   67    68    69    70    71    72  
   68    69    70  
   69    70    71    72  
   70    71    72  
   71    72  
   72  
    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  -0.316400   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   0.571400   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -1.222500   1.7825   1.5750   0.001000000  -0.126889456
   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   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   40   2.9000   0.1400  -0.300000   1.7660   1.5600   0.020110767  -0.896042159
   41   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0700  -0.019000   2.5000   1.7750   0.001000000  -0.843144165
   44   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   47   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5500   0.0700  -0.107200   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.192900   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660   0.364700   1.9750   1.7500   0.005000000  -0.741685710
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.2500   0.1700  -0.478600   1.8650   1.6500   0.001000000  -0.511443539
   54   0.5000   0.0300   0.357700   0.9960   0.8600   0.030040813  -0.651083722
   55   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   56   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.1200   0.1700  -0.582700   1.7660   1.5600   0.021068034  -0.322181743
   60   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   61   3.5500   0.0700   0.286000   2.5000   1.7750   0.001000000  -0.843144165
   62   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   63   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   64   3.5500   0.0700  -0.354100   2.5000   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.179600   1.3810   1.2100   0.030040813   0.268726247
   66   3.5500   0.0700  -0.088800   2.0020   1.7750   0.001000000  -0.843144165
   67   2.4200   0.0300   0.135900   1.3810   1.2100   0.030040813   0.268726247
   68   3.5500   0.0700  -0.222200   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.148900   1.3810   1.2100   0.030040813   0.268726247
   70   3.5500   0.0700  -0.224300   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.169900   1.3810   1.2100   0.030040813   0.268726247
   72   3.5500   0.0700   0.123300   2.5000   1.7750   0.001000000  -0.843144165
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   570.000  1.307
   33    38   268.000  1.529
   33    40   320.000  1.410
   38    39   340.000  1.090
   38    41   268.000  1.529
   38    55   320.000  1.410
   41    42   340.000  1.090
   41    44   268.000  1.529
   41    46   320.000  1.410
   44    45   340.000  1.090
   44    50   250.000  1.527
   44    51   320.000  1.410
   50    55   320.000  1.380
   50    56   250.000  1.527
   50    59   380.000  1.407
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    62   320.000  1.410
   62    63   553.000  0.945
   59    60   553.000  0.945
   51    52   553.000  0.945
   46    47   553.000  0.945
   40    43   480.000  1.345
   43    48   520.000  1.370
   43    72   380.000  1.440
   48    49   367.000  1.080
   48    53   427.000  1.381
   53    54   434.000  1.010
   53    61   428.000  1.380
   61    64   469.000  1.400
   61    72   447.000  1.419
   64    65   367.000  1.080
   64    66   469.000  1.400
   66    67   367.000  1.080
   66    68   469.000  1.400
   68    69   367.000  1.080
   68    70   469.000  1.400
   70    71   367.000  1.080
   70    72   469.000  1.404
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    85.00000  114.68000
   29    33    38    75.00000  111.63000
   29    33    40    85.00000  114.68000
   33    38    39    37.50000  110.70000
   33    38    41    58.35000  112.70000
   33    38    55    50.00000  109.50000
   33    40    43    90.00000  112.30700
   38    33    34    50.00000  109.50000
   38    41    42    37.50000  110.70000
   38    41    44    58.35000  112.70000
   38    41    46    50.00000  109.50000
   38    55    50    60.00000  109.50000
   41    38    39    37.50000  110.70000
   41    44    45    37.50000  110.70000
   41    44    50    75.00000  109.43000
   41    44    51    50.00000  109.50000
   41    46    47    55.00000  108.50000
   44    41    42    37.50000  110.70000
   44    50    55    90.00000  108.56700
   44    50    56    65.00000  112.71400
   44    50    59    90.00000  110.19100
   44    51    52    55.00000  108.50000
   50    44    45    45.00000  108.72000
   50    56    57    45.00000  108.72000
   50    56    58    45.00000  108.72000
   50    56    62    90.00000  111.58700
   50    59    60    70.00000  107.92000
   55    38    39    35.00000  109.50000
   55    38    41    50.00000  109.50000
   56    50    55    90.00000  108.56700
   56    62    63    55.00000  108.50000
   58    56    57    33.00000  107.80000
   62    56    57    35.00000  109.50000
   62    56    58    35.00000  109.50000
   59    50    55   110.00000  112.08000
   59    50    56    90.00000  110.19100
   51    44    45    35.00000  109.50000
   51    44    50    90.00000  111.58700
   46    41    42    35.00000  109.50000
   46    41    44    50.00000  109.50000
   40    33    34   110.00000  112.65000
   40    33    38    50.00000  109.50000
   40    43    48    75.00000  125.18600
   40    43    72    80.00000  117.00000
   43    48    49    35.00000  130.70000
   43    48    53    70.00000  106.30000
   43    72    61    80.00000  107.43600
   43    72    70    50.00000  134.85500
   48    53    54    35.00000  120.00000
   48    53    61    90.00000  107.14200
   53    48    49    35.00000  121.60000
   53    61    64    70.00000  132.80000
   53    61    72    70.00000  104.40000
   61    53    54    35.00000  123.10000
   61    64    65    35.00000  120.00000
   61    64    66    85.00000  120.00000
   61    72    70    85.00000  116.20000
   64    66    67    35.00000  120.00000
   64    66    68    63.00000  120.00000
   66    64    65    35.00000  120.00000
   66    68    69    35.00000  120.00000
   66    68    70    63.00000  120.00000
   68    66    67    35.00000  120.00000
   68    70    71    35.00000  120.00000
   68    70    72    63.00000  120.00000
   70    68    69    35.00000  120.00000
   72    43    48    80.00000  105.82900
   72    61    64    85.00000  122.70000
   72    70    71    35.00000  120.00000
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    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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  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    40   0.13850  1.0 1.0
   24    29    33    40  -1.34450 -1.0 2.0
   24    29    33    40   0.57400  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    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    38    55   0.56750  1.0 1.0
   29    33    38    55  -0.07550 -1.0 2.0
   29    33    38    55   0.20000  1.0 3.0
   29    33    40    43   0.14700  1.0 1.0
   29    33    40    43  -1.16150 -1.0 2.0
   29    33    40    43   0.48700  1.0 3.0
   33    38    41    42   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    38    41    46   0.86500  1.0 1.0
   33    38    41    46  -0.17500 -1.0 2.0
   33    38    41    46   0.20800  1.0 3.0
   33    38    55    50   0.06250  1.0 1.0
   33    38    55    50  -0.01100 -1.0 2.0
   33    38    55    50   0.28050  1.0 3.0
   33    40    43    48   1.63200 -1.0 2.0
   33    40    43    72   1.63200 -1.0 2.0
   34    33    38    39   0.23400  1.0 3.0
   34    33    38    41   0.62750  1.0 1.0
   34    33    38    41  -0.30950 -1.0 2.0
   34    33    38    41   0.27300  1.0 3.0
   34    33    38    55   1.11900  1.0 1.0
   34    33    38    55  -1.16350 -1.0 2.0
   34    33    38    55  -0.34150  1.0 3.0
   34    33    40    43  -0.25600  1.0 1.0
   34    33    40    43  -0.40050 -1.0 2.0
   34    33    40    43   0.34700  1.0 3.0
   38    33    40    43  -0.32850  1.0 1.0
   38    33    40    43  -0.35800 -1.0 2.0
   38    33    40    43   0.33950  1.0 3.0
   38    41    44    45   0.15000  1.0 3.0
   38    41   -44    50   3.97050  1.0 1.0
   38    41    44    51   0.86500  1.0 1.0
   38    41    44    51  -0.17500 -1.0 2.0
   38    41    44    51   0.20800  1.0 3.0
   38    41    46    47  -0.11600  1.0 1.0
   38    41    46    47  -0.09450 -1.0 2.0
   38    41    46    47   0.21250  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    44   0.15000  1.0 3.0
   39    38    41    46   0.23400  1.0 3.0
   39    38    55    50   0.37050  1.0 3.0
   41    38   -55    50   0.06250  1.0 1.0
   41    38   -55    50  -0.01100 -1.0 2.0
   41    38   -55    50   0.28050  1.0 3.0
   41    44   -50    55   0.62750  1.0 1.0
   41    44   -50    55  -0.30950 -1.0 2.0
   41    44   -50    55   0.27300  1.0 3.0
   41    44    50    56   0.56750  1.0 1.0
   41    44    50    56  -0.07550 -1.0 2.0
   41    44    50    56   0.20000  1.0 3.0
   41    44    50    59   0.86500  1.0 1.0
   41    44    50    59  -0.17500 -1.0 2.0
   41    44    50    59   0.20800  1.0 3.0
   41    44    51    52  -0.11600  1.0 1.0
   41    44    51    52  -0.09450 -1.0 2.0
   41    44    51    52   0.21250  1.0 3.0
   42    41    44    45   0.15000  1.0 3.0
   42    41    44    50   0.15000  1.0 3.0
   42    41    44    51   0.23400  1.0 3.0
   42    41    46    47   0.19450  1.0 3.0
   44    41    46    47  -0.11600  1.0 1.0
   44    41    46    47  -0.09450 -1.0 2.0
   44    41    46    47   0.21250  1.0 3.0
   44    50   -55    38   0.06250  1.0 1.0
   44    50   -55    38  -0.01100 -1.0 2.0
   44    50   -55    38   0.28050  1.0 3.0
   44    50    56    57   0.15000  1.0 3.0
   44    50    56    58   0.15000  1.0 3.0
   44    50    56    62   0.86500  1.0 1.0
   44    50    56    62  -0.17500 -1.0 2.0
   44    50    56    62   0.20800  1.0 3.0
   44    50    59    60  -0.11600  1.0 1.0
   44    50    59    60  -0.09450 -1.0 2.0
   44    50    59    60   0.21250  1.0 3.0
   45    44    50    55   0.23400  1.0 3.0
   45    44    50    56   0.15000  1.0 3.0
   45    44    50    59   0.23400  1.0 3.0
   45    44    51    52   0.19450  1.0 3.0
   50    44    51    52  -0.11600  1.0 1.0
   50    44    51    52  -0.09450 -1.0 2.0
   50    44    51    52   0.21250  1.0 3.0
   50    56    62    63  -0.11600  1.0 1.0
   50    56    62    63  -0.09450 -1.0 2.0
   50    56    62    63   0.21250  1.0 3.0
   55    38    41    42   0.23400  1.0 3.0
   55    38   -41    44   0.62750  1.0 1.0
   55    38   -41    44  -0.30950 -1.0 2.0
   55    38   -41    44   0.27300  1.0 3.0
   55    38    41    46   3.69350  1.0 1.0
   55    38    41    46  -1.82950 -1.0 2.0
   55    50    56    57   0.23400  1.0 3.0
   55    50    56    58   0.23400  1.0 3.0
   55    50    56    62   3.69350  1.0 1.0
   55    50    56    62  -1.82950 -1.0 2.0
   55    50    59    60  -0.50000  1.0 1.0
   55    50    59    60  -0.73950 -1.0 2.0
   55    50    59    60   0.17150  1.0 3.0
   56    50    55    38   0.06250  1.0 1.0
   56    50    55    38  -0.01100 -1.0 2.0
   56    50    55    38   0.28050  1.0 3.0
   56    50    59    60  -0.11600  1.0 1.0
   56    50    59    60  -0.09450 -1.0 2.0
   56    50    59    60   0.21250  1.0 3.0
   57    56    62    63   0.19450  1.0 3.0
   58    56    62    63   0.19450  1.0 3.0
   59    50    55    38  -0.70900  1.0 1.0
   59    50    55    38  -1.18000 -1.0 2.0
   59    50    55    38   0.91650  1.0 3.0
   59    50    56    57   0.23400  1.0 3.0
   59    50    56    58   0.23400  1.0 3.0
   59    50    56    62   3.75450  1.0 1.0
   51    44    50    55   3.69350  1.0 1.0
   51    44    50    55  -1.82950 -1.0 2.0
   51    44    50    56   0.86500  1.0 1.0
   51    44    50    56  -0.17500 -1.0 2.0
   51    44    50    56   0.20800  1.0 3.0
   51    44    50    59   3.75450  1.0 1.0
   46    41    44    45   0.23400  1.0 3.0
   46    41    44    50   0.86500  1.0 1.0
   46    41    44    50  -0.17500 -1.0 2.0
   46    41    44    50   0.20800  1.0 3.0
   46    41    44    51   3.75450  1.0 1.0
   40    33    38    39   0.23400  1.0 3.0
   40    33    38    41   0.62750  1.0 1.0
   40    33    38    41  -0.30950 -1.0 2.0
   40    33    38    41   0.27300  1.0 3.0
   40    33    38    55   1.11900  1.0 1.0
   40    33    38    55  -1.16350 -1.0 2.0
   40    33    38    55  -0.34150  1.0 3.0
   40    43    48    49   3.62500 -1.0 2.0
   40    43    48    53   3.62500 -1.0 2.0
   40    43    72    61   3.62500 -1.0 2.0
   40    43    72    70   3.62500 -1.0 2.0
   43    48    53    54   1.40000 -1.0 2.0
   43    48   -53    61   3.62500 -1.0 2.0
   48    43   -72    61   3.50000 -1.0 2.0
   48    43    72    70   3.62500 -1.0 2.0
   48    53    61    64   3.62500 -1.0 2.0
   48    53   -61    72   3.62500 -1.0 2.0
   49    48    53    54   2.00000 -1.0 2.0
   49    48    53    61   3.62500 -1.0 2.0
   53    61    64    65   3.62500 -1.0 2.0
   53    61    64    66   3.62500 -1.0 2.0
   53    61   -72    43   3.00000 -1.0 2.0
   53    61    72    70   3.00000 -1.0 2.0
   54    53    61    64   1.52500 -1.0 2.0
   54    53    61    72   1.52500 -1.0 2.0
   61    64    66    67   3.62500 -1.0 2.0
   61    64    66    68   3.62500 -1.0 2.0
   64    61    72    43   3.00000 -1.0 2.0
   64    61    72    70   3.00000 -1.0 2.0
   64    66    68    69   3.62500 -1.0 2.0
   64    66   -68    70   3.62500 -1.0 2.0
   65    64    66    67   3.62500 -1.0 2.0
   65    64    66    68   3.62500 -1.0 2.0
   66    68    70    71   3.62500 -1.0 2.0
   66    68    70    72   3.62500 -1.0 2.0
   67    66    68    69   3.62500 -1.0 2.0
   67    66    68    70   3.62500 -1.0 2.0
   68    70    72    43   3.62500 -1.0 2.0
   68    70   -72    61   3.50000 -1.0 2.0
   69    68    70    71   3.62500 -1.0 2.0
   69    68    70    72   3.62500 -1.0 2.0
   71    70    72    43   3.62500 -1.0 2.0
   71    70    72    61   3.50000 -1.0 2.0
   72    43    48    49   3.62500 -1.0 2.0
   72    43   -48    53   3.62500 -1.0 2.0
   72    61    64    65   3.62500 -1.0 2.0
   72    61   -64    66   3.62500 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   48    72    43    40   4.00000 -1.0 2.0
   53    49    48    43   1.10000 -1.0 2.0
   54    48    53    61   1.00000 -1.0 2.0
   64    72    61    53   4.00000 -1.0 2.0
   66    65    64    61   1.10000 -1.0 2.0
   68    67    66    64   1.10000 -1.0 2.0
   70    69    68    66   1.10000 -1.0 2.0
   72    71    70    68   1.10000 -1.0 2.0
   61    70    72    43   4.00000 -1.0 2.0
END
