* LIGAND DATABASE FILE (OPLS2005)
*
001      74    74    128    184     368
    1     0 S   NP   _N1_     1    28.65320    98.36773   -20.08139
    2     1 S   H    _HN1     2     1.02943    66.13882   -13.77794
    3     1 S   H    _H1_     3     1.02844    48.53951   131.59947
    4     1 S   H    _H2_     4     1.02786    96.90429  -120.70217
    5     1 S   CT   _CA1     5     1.50116   149.60883    76.48605
    6     5 S   HC   _HA1     6     1.09599   105.18823   100.75545
    7     5 S   CO3  _C1_     7     1.53881   111.90333   -19.00427
    8     7 S   O2Z  _O11     8     1.26342   115.09574   -57.22519
    9     7 S   O2Z  _O12     9     1.26272   114.89242   121.47338
   10     5 S   CT   _CB1    10     1.53158   107.31746  -141.86205
   11    10 S   HC   HB11    11     1.09821   109.45217   -52.36681
   12    10 S   HC   HB12    12     1.09800   110.54505    64.28560
   13    10 S   CT   _CG1    13     1.52888   112.30877  -173.35273
   14    13 S   HC   HG11    14     1.09340   109.98980   -64.86863
   15    13 S   HC   HG12    15     1.09644   109.95727    54.23654
   16    13 S   C    _CD1    16     1.51754   112.57317   175.46119
   17    16 S   O    _OE1    17     1.22755   123.22289     8.77234
   18    16 S   N    _N2_    18     1.38604   111.82200  -171.79338
   19    18 S   H    _HN2    19     1.01563   118.94316     4.88471
   20    18 S   CT1  _CA2    20     1.45757   122.73786   177.61214
   21    20 S   HC   _HA2    21     1.09719   108.81325    28.23810
   22    20 S   C    _C2_    22     1.52970   106.88767   -88.84897
   23    22 S   O    _O2_    23     1.22976   123.03863   -28.02094
   24    20 S   CT   _CB2    32     1.53155   112.52031   151.68158
   25    24 S   HC   HB21    33     1.09501   110.40731    55.97045
   26    24 S   HC   HB22    34     1.09561   110.20441   173.44390
   27    22 S   N    _N3_    24     1.38486   112.55304   154.83502
   28    27 S   H    _HN3    25     1.01649   120.38469    -2.37422
   29    24 S   S    _SG2    35     1.82856   111.82661   -67.92077
   30    27 S   CT   _CA3    26     1.45360   122.49665   178.56865
   31    30 S   HC   HA31    27     1.09566   107.84619   -55.19323
   32    30 S   HC   HA32    28     1.09561   107.58525    61.15429
   33    29 S   CT   _C12    36     1.84408   100.11339   126.26168
   34    33 S   HC   _H3_    37     1.09734   106.65114    42.99820
   35    30 S   CO3  _C3_    29     1.52895   114.29459  -177.10362
   36    35 S   O2Z  _O31    30     1.26340   116.04499     0.47888
   37    35 S   O2Z  _O32    31     1.26433   114.41824  -179.57387
   38    33 S   CA   _C7_    38     1.52076   110.90993   -76.30295
   39    33 S   CT   _C13    58     1.53561   108.78997   158.47739
   40    39 S   HC   _H14    59     1.09648   113.41287    69.78483
   41    39 S   HC   _H15    60     1.09813   111.16883   -49.48810
   42    38 S   CA   _C6_    39     1.40626   119.51074   114.31583
   43    42 S   HA   _H8_    40     1.08639   118.29173     0.95121
   44    39 S   CO4  _C14    61     1.51024   110.47824  -167.11831
   45    44 S   O    _O36    62     1.22403   123.31343    85.77355
   46    42 S   CA   _C5_    41     1.39770   120.96093  -178.57646
   47    44 S   OS   _O37    63     1.36130   109.86352   -92.37491
   48    46 S   CA   _C10    42     1.39894   118.71502     0.08156
   49    46 S   OS   _O33    53     1.37054   125.09072   178.94001
   50    47 S   CT   _C15    64     1.44628   117.89446   176.57675
   51    50 S   HC   _H4_    65     1.09722   111.04908    24.93898
   52    48 S   CA   _C9_    43     1.39991   121.54313    -1.59545
   53    48 S   OH   _O34    51     1.37361   118.62659   177.63222
   54    53 S   HO   _H10    52     0.97620   107.68798  -170.12916
   55    49 S   CT   _C4_    54     1.42227   116.97786     8.90878
   56    55 S   HC   _H5_    55     1.09428   107.73331   175.19560
   57    55 S   HC   _H6_    56     1.09499   111.34900    57.36612
   58    55 S   HC   _H7_    57     1.09485   110.97927   -67.21430
   59    50 S   CO3  _C18    66     1.54318   106.48091   -93.40690
   60    59 S   O2Z  _O41    67     1.26276   116.54608   -97.62352
   61    59 S   O2Z  _O40    68     1.26593   114.58591    82.08341
   62    50 S   CT   _C16    69     1.52601   107.47201   144.93167
   63    62 S   HC   _H16    70     1.09814   109.85572    47.91168
   64    62 S   HC   _H17    71     1.09741   109.65929   166.04628
   65    38 S   CA   _C8_    44     1.40642   121.48337   -65.47212
   66    65 S   HA   _H9_    45     1.08578   118.57204    -0.73966
   67    52 S   OS   _O35    46     1.36977   115.65156  -178.65827
   68    62 S   CO3  _C17    72     1.53338   115.89026   -73.03844
   69    68 S   O2Z  _O39    73     1.26600   114.00779   178.57179
   70    68 S   O2Z  _O38    74     1.26123   116.94647    -1.51788
   71    67 S   CT   _C11    47     1.42197   117.18599  -176.32928
   72    71 S   HC   _H11    48     1.09422   107.74796   178.48923
   73    71 S   HC   _H12    49     1.09509   111.14747    60.73571
   74    71 S   HC   _H13    50     1.09489   111.09936   -63.79613
  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   9   5   4   3
  14   7   2   1   1  13   8   4   3   9   4   6   2  11   9   9
   6  10   7   9   3   1   3   2   1   1   6   2   1   5   4   3
   3   1   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    65    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    46    52    65    66    39    40    41    44    45    47  
   38    42    65    39    40    41    44  
   36    37  
   37  
    0  
   42    43    46    48    52    65    66    67    49    39    40    41    44  
   40    41    44    45    47    50    42    65  
   41    44    45    47  
   44    45    47  
   43    46    48    52    65    66    53    49    55  
   46    48    65    49  
   45    47    50    51    59    62  
   47    50  
   48    52    65    67    53    54    49    55    56    57    58  
   50    51    59    60    61    62    63    64    68  
   52    65    66    67    71    53    54    49    55  
   55    56    57    58    52    53  
   51    59    60    61    62    63    64    68    69    70  
   59    60    61    62    63    64    68  
   65    66    67    71    72    73    74    53    54  
   54    65    67  
    0  
   56    57    58  
   57    58  
   58  
    0  
   60    61    62    63    64    68  
   61    62  
   62  
   63    64    68    69    70  
   64    68    69    70  
   68    69    70  
   66    67    71  
   67  
   71    72    73    74  
   69    70  
   70  
    0  
   72    73    74  
   73    74  
   74  
    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   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   50   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   54   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   55   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   60   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   61   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   62   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   68   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   69   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   70   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   71   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.030000   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   317.000  1.510
   33    39   268.000  1.529
   38    42   469.000  1.400
   38    65   469.000  1.400
   42    43   367.000  1.080
   42    46   469.000  1.400
   46    48   469.000  1.400
   46    49   450.000  1.364
   48    52   469.000  1.400
   48    53   450.000  1.364
   52    65   469.000  1.400
   52    67   450.000  1.364
   65    66   367.000  1.080
   67    71   320.000  1.410
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   53    54   553.000  0.945
   49    55   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   317.000  1.522
   44    45   570.000  1.229
   44    47   214.000  1.327
   47    50   320.000  1.410
   50    51   340.000  1.090
   50    59   317.000  1.522
   50    62   268.000  1.529
   59    60   656.000  1.250
   59    61   656.000  1.250
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    68   317.000  1.522
   68    69   656.000  1.250
   68    70   656.000  1.250
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    42    70.00000  120.00000
   33    38    65    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    44    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    42    43    35.00000  120.00000
   38    42    46    63.00000  120.00000
   38    65    52    63.00000  120.00000
   38    65    66    35.00000  120.00000
   42    46    48    63.00000  120.00000
   42    46    49    70.00000  120.00000
   46    42    43    35.00000  120.00000
   46    48    52    63.00000  120.00000
   46    48    53    70.00000  120.00000
   46    49    55    75.00000  111.00000
   48    52    65    63.00000  120.00000
   48    52    67    70.00000  120.00000
   48    53    54    35.00000  113.00000
   52    65    66    35.00000  120.00000
   52    67    71    75.00000  111.00000
   65    38    42    63.00000  120.00000
   67    52    65    70.00000  120.00000
   67    71    72    35.00000  109.50000
   67    71    73    35.00000  109.50000
   67    71    74    35.00000  109.50000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   53    48    52    70.00000  120.00000
   49    46    48    70.00000  120.00000
   49    55    56    35.00000  109.50000
   49    55    57    35.00000  109.50000
   49    55    58    35.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    44    45    80.00000  120.40000
   39    44    47    81.00000  111.40000
   41    39    40    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    41    35.00000  109.50000
   44    47    50    83.00000  116.90000
   47    44    45    83.00000  123.40000
   47    50    51    35.00000  109.50000
   47    50    59    85.00000  109.63000
   47    50    62    50.00000  109.50000
   50    59    60    70.00000  117.00000
   50    59    61    70.00000  117.00000
   50    62    63    37.50000  110.70000
   50    62    64    37.50000  110.70000
   50    62    68    70.00000  109.69300
   59    50    51    35.00000  109.50000
   61    59    60    80.00000  126.00000
   62    50    51    37.50000  110.70000
   62    50    59    70.00000  109.69300
   62    68    69    70.00000  117.00000
   62    68    70    70.00000  117.00000
   64    62    63    33.00000  107.80000
   68    62    63    35.00000  109.50000
   68    62    64    35.00000  109.50000
   70    68    69    80.00000  126.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    42  -0.16000  1.0 1.0
   29    33    38    42  -0.03200 -1.0 2.0
   29    33    38    42   0.04500  1.0 3.0
   29    33    38    65  -0.16000  1.0 1.0
   29    33    38    65  -0.03200 -1.0 2.0
   29    33    38    65   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    42    43   3.62500 -1.0 2.0
   33    38    42    46   3.62500 -1.0 2.0
   33    38    65    52   3.62500 -1.0 2.0
   33    38    65    66   3.62500 -1.0 2.0
   33    39    44    45   0.30150 -1.0 2.0
   33    39    44    47   0.36750  1.0 3.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    65   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    44  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    41   0.43200  1.0 3.0
   38    33    39    44   0.56750  1.0 1.0
   38    33    39    44  -0.07550 -1.0 2.0
   38    33    39    44   0.20000  1.0 3.0
   38    42    46    48   3.62500 -1.0 2.0
   38    42    46    49   3.62500 -1.0 2.0
   42    38    65    52   3.62500 -1.0 2.0
   42    38    65    66   3.62500 -1.0 2.0
   42    46   -48    52   3.62500 -1.0 2.0
   42    46    48    53   3.62500 -1.0 2.0
   42    46    49    55   1.63200 -1.0 2.0
   43    42    46    48   3.62500 -1.0 2.0
   43    42    46    49   3.62500 -1.0 2.0
   46    48    52    65   3.62500 -1.0 2.0
   46    48    52    67   3.62500 -1.0 2.0
   46    48    53    54   0.84100 -1.0 2.0
   46    49    55    56   0.08050  1.0 3.0
   46    49    55    57   0.08050  1.0 3.0
   46    49    55    58   0.08050  1.0 3.0
   48    46    49    55   1.63200 -1.0 2.0
   48    52   -65    38   3.62500 -1.0 2.0
   48    52    65    66   3.62500 -1.0 2.0
   48    52    67    71   1.63200 -1.0 2.0
   52    48    53    54   0.84100 -1.0 2.0
   52    67    71    72   0.08050  1.0 3.0
   52    67    71    73   0.08050  1.0 3.0
   52    67    71    74   0.08050  1.0 3.0
   65    38    42    43   3.62500 -1.0 2.0
   65    38   -42    46   3.62500 -1.0 2.0
   65    52    67    71   1.63200 -1.0 2.0
   67    52    65    38   3.62500 -1.0 2.0
   67    52    65    66   3.62500 -1.0 2.0
   53    48    52    65   3.62500 -1.0 2.0
   53    48    52    67   3.62500 -1.0 2.0
   49    46    48    52   3.62500 -1.0 2.0
   49    46    48    53   3.62500 -1.0 2.0
   39    33    38    42   0.04150 -1.0 2.0
   39    33    38    65   0.04150 -1.0 2.0
   39    44    47    50   1.63150  1.0 1.0
   39    44    47    50   2.92000 -1.0 2.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    47   0.00000  1.0 1.0
   41    39    44    45   0.00000  1.0 1.0
   41    39    44    47   0.00000  1.0 1.0
   44    47    50    51   0.08050  1.0 3.0
   44    47    50    59  -1.80650  1.0 1.0
   44    47    50    59   0.63900 -1.0 2.0
   44    47    50    59   0.03650  1.0 3.0
   44    47    50    62  -0.25900  1.0 1.0
   44    47    50    62  -0.47000 -1.0 2.0
   44    47    50    62   0.11750  1.0 3.0
   45    44    47    50   3.00000 -1.0 2.0
   47    50    59    60   0.30150 -1.0 2.0
   47    50    59    61   0.30150 -1.0 2.0
   47    50    62    63   0.23400  1.0 3.0
   47    50    62    64   0.23400  1.0 3.0
   47    50    62    68  -3.35100  1.0 1.0
   47    50    62    68  -0.37050 -1.0 2.0
   47    50    62    68   0.22400  1.0 3.0
   50    62    68    69   0.41150 -1.0 2.0
   50    62    68    70   0.41150 -1.0 2.0
   51    50    59    60   0.00000  1.0 1.0
   51    50    59    61   0.00000  1.0 1.0
   51    50    62    63   0.15000  1.0 3.0
   51    50    62    64   0.15000  1.0 3.0
   51    50    62    68  -0.11250  1.0 3.0
   59    50    62    63  -0.11250  1.0 3.0
   59    50    62    64  -0.11250  1.0 3.0
   59    50    62    68  -0.30950  1.0 1.0
   59    50    62    68   1.11150 -1.0 2.0
   59    50    62    68   0.40350  1.0 3.0
   62    50    59    60   0.41150 -1.0 2.0
   62    50    59    61   0.41150 -1.0 2.0
   63    62    68    69   0.00000  1.0 1.0
   63    62    68    70   0.00000  1.0 1.0
   64    62    68    69   0.00000  1.0 1.0
   64    62    68    70   0.00000  1.0 1.0
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
   42    65    38    33   4.00000 -1.0 2.0
   46    43    42    38   1.10000 -1.0 2.0
   48    49    46    42   4.00000 -1.0 2.0
   52    53    48    46   4.00000 -1.0 2.0
   65    67    52    48   4.00000 -1.0 2.0
   52    66    65    38   1.10000 -1.0 2.0
   39    47    44    45  10.50000 -1.0 2.0
   60    50    59    61  10.50000 -1.0 2.0
   69    62    68    70  10.50000 -1.0 2.0
END
