* LIGAND DATABASE FILE (OPLS2005)
*
001      73    73    127    190     372
    1     0 S   NP   _N1_     1    30.87024   100.76374   -22.98293
    2     1 S   H    _HN1     2     1.02841    50.94504   -67.33077
    3     1 S   H    _H1_     3     1.02752    72.54928   161.74311
    4     1 S   H    _H2_     4     1.03457   155.30389  -103.62328
    5     1 S   CT   _CA1     5     1.50180    90.00535    49.82545
    6     5 S   HC   _HA1     6     1.09540   104.78433   129.38154
    7     5 S   CO3  _C1_     7     1.53786   113.54019     9.10446
    8     7 S   O2Z  _O11     8     1.26436   115.05206   -23.21697
    9     7 S   O2Z  _O12     9     1.26231   115.17834   156.35867
   10     5 S   CT   _CB1    10     1.53060   107.36280  -111.98086
   11    10 S   HC   HB11    11     1.09479   109.64852   -35.89029
   12    10 S   HC   HB12    12     1.09828   110.57054    79.95639
   13    10 S   CT   _CG1    13     1.53075   112.80494  -157.99005
   14    13 S   HC   HG11    14     1.09514   111.21990   -87.88447
   15    13 S   HC   HG12    15     1.09414   110.72095    31.38618
   16    13 S   C    _CD1    16     1.51491   109.52663   151.68129
   17    16 S   O    _OE1    17     1.22817   121.78988    85.30851
   18    16 S   N    _N2_    18     1.38637   112.65732   -91.34495
   19    18 S   H    _HN2    19     1.01626   119.11796    -5.27377
   20    18 S   CT1  _CA2    20     1.46161   123.36638   171.72630
   21    20 S   HC   _HA2    21     1.09709   109.11688    -9.28296
   22    20 S   C    _C2_    22     1.53876   108.90443  -124.97603
   23    22 S   O    _O2_    23     1.23083   122.01289  -157.45419
   24    20 S   CT   _CB2    32     1.53371   112.15671   113.07657
   25    24 S   HC   HB21    33     1.09419   109.98834    61.41924
   26    24 S   HC   HB22    34     1.09560   110.13025   178.57783
   27    22 S   N    _N3_    24     1.38295   114.08145    29.08099
   28    27 S   H    _HN3    25     1.01412   119.07477    -2.36976
   29    24 S   S    _SG2    35     1.82890   112.46465   -62.62412
   30    27 S   CT   _CA3    26     1.45324   123.52851   178.48225
   31    30 S   HC   HA31    27     1.09554   107.23469   -68.25965
   32    30 S   HC   HA32    28     1.09551   108.17665    48.07341
   33    29 S   CT   _C12    36     1.85731   100.17498   130.30783
   34    33 S   HC   _H4_    37     1.09796   106.32630    45.24149
   35    30 S   CO3  _C3_    29     1.53088   114.30571   170.00546
   36    35 S   O2Z  _O31    30     1.26450   116.31842   -10.51592
   37    35 S   O2Z  _O32    31     1.26400   114.46587   169.59754
   38    33 S   CA   _C13    38     1.52246   109.80587   -72.70018
   39    33 S   CT   _C9_    52     1.55841   109.87077   162.18963
   40    39 S   HC   _H3_    53     1.09284   108.28841    59.92309
   41    38 S   CA   _C14    39     1.39645   119.92882   112.39403
   42    41 S   HA   _H16    40     1.08796   120.07474     0.58450
   43    39 S   CZ   _C10    54     1.48300   110.55995   179.15466
   44    39 S   C    _C8_    57     1.53969   111.41474   -61.80950
   45    44 S   O    _O33    58     1.23650   119.79346   -36.17854
   46    41 S   CA   _C15    41     1.40627   119.82415  -178.93210
   47    43 S   CZ   _C11    55     1.20078   179.74589  -100.61340
   48    47 S   HC   _H15    56     1.06501   179.84298    68.89934
   49    44 S   N    _N4_    59     1.40051   117.86068   145.51155
   50    46 S   CA   _C16    42     1.41435   125.13853    -0.32203
   51    50 S   OM   _O35    43     1.28001   125.00427   179.47177
   52    46 S   NO2  _N5_    49     1.45005   115.36653   179.03369
   53    52 S   ON   _O37    50     1.23821   117.00454    91.05051
   54    52 S   ON   _O36    51     1.23844   116.86233   -87.05936
   55    49 S   CT   _C5_    60     1.46910   125.30631     3.25372
   56    55 S   HC   _H8_    61     1.09279   110.21110    29.75787
   57    55 S   HC   _H9_    62     1.09586   108.54505   145.80009
   58    49 S   CT   _C6_    67     1.46643   118.36762  -177.99455
   59    58 S   HC   _H10    68     1.09578   109.27637    30.45358
   60    58 S   HC   _H11    69     1.09532   109.05698   147.23777
   61    50 S   CA   _C17    44     1.41379   112.21579    -0.24708
   62    55 S   CT   _C4_    63     1.52096   111.79347   -92.84577
   63    62 S   HC   _H5_    64     1.09473   111.09921   -60.81593
   64    62 S   HC   _H6_    65     1.09427   111.47318    59.10933
   65    62 S   HC   _H7_    66     1.09429   110.26962   179.36020
   66    58 S   CT   _C7_    70     1.52070   111.71119   -90.30550
   67    66 S   HC   _H12    71     1.09463   111.21239   -60.47588
   68    66 S   HC   _H13    72     1.09492   111.08284    59.45875
   69    66 S   HC   _H14    73     1.09427   110.31581   179.48111
   70    38 S   CA   _C18    45     1.39815   122.25806   -67.21956
   71    70 S   HA   _H17    46     1.08728   120.60065     0.00000
   72    61 S   OH   _O34    47     1.37981   119.68969   179.37130
   73    72 S   HO   _H18    48     0.97553   105.96641    -2.60542
  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
  15   7   2   1   1  13  11   5  10   4   5  11   3   8   1   1
  14   9   4   3   1   1  10   6   5   7   5   4   4   3   2   1
   1   3   2   1   1   3   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    70    39    40    43    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    46    61    70    71    39    40    43    47    44    45    49  
   38    41    70    39    40    43    44  
   36    37  
   37  
    0  
   41    42    46    50    61    70    71    72    52    39    40    43    44  
   40    43    47    48    44    45    49    55    58    41    70  
   43    47    44    45    49  
   42    46    50    51    61    70    71    52    53    54  
   46    50    70    52  
   47    48    44    45    49  
   45    49    55    56    57    62    58    59    60    66    47  
   49    55    58  
   50    51    61    70    72    52    53    54  
   48  
    0  
   55    56    57    62    63    64    65    58    59    60    66    67    68    69  
   51    61    70    71    72    73    52    53    54  
   61    70    72    52  
   53    54    61  
   54  
    0  
   56    57    62    63    64    65    58    59    60    66  
   57    62    63    64    65    58  
   62    63    64    65    58  
   59    60    66    67    68    69    62  
   60    66    67    68    69  
   66    67    68    69  
   70    71    72    73  
   63    64    65  
   64    65  
   65  
    0  
   67    68    69  
   68    69  
   69  
    0  
   71    72    73  
   72  
   73  
    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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.6500   0.1500   0.010000   2.0580   1.8250   0.025318638  -1.264311570
   44   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   46   3.5500   0.0700   0.090000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.6500   0.1500  -0.210000   2.0580   1.8250   0.025318638  -1.264311570
   48   2.4200   0.0300   0.200000   1.3810   1.2100   0.008598240   0.268726247
   49   3.2500   0.1700  -0.140000   1.8100   1.6000   0.054801302  -1.445846770
   50   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   51   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   52   3.2500   0.1700   0.650000   1.8650   1.6500   0.020864068  -0.347800883
   53   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   54   2.9600   0.1700  -0.370000   1.8650   1.6500   0.020881802  -0.347800883
   55   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   3.5000   0.0660  -0.050000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   72   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   268.000  1.529
   38    41   469.000  1.400
   38    70   469.000  1.400
   41    42   367.000  1.080
   41    46   469.000  1.400
   46    50   469.000  1.400
   46    52   400.000  1.460
   50    51   450.000  1.364
   50    61   469.000  1.400
   61    70   469.000  1.400
   61    72   450.000  1.364
   70    71   367.000  1.080
   72    73   553.000  0.945
   52    53   550.000  1.225
   52    54   550.000  1.225
   39    40   340.000  1.090
   39    43   390.000  1.470
   39    44   317.000  1.522
   43    47   985.000  1.221
   47    48   410.000  1.067
   44    45   570.000  1.229
   44    49   490.000  1.335
   49    55   337.000  1.449
   49    58   337.000  1.449
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    41    70.00000  120.00000
   33    38    70    70.00000  120.00000
   33    39    40    37.50000  110.70000
   33    39    43    58.35000  112.70000
   33    39    44    63.00000  111.10000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    46    63.00000  120.00000
   38    70    61    63.00000  120.00000
   38    70    71    35.00000  120.00000
   41    46    50    63.00000  120.00000
   41    46    52    85.00000  120.00000
   46    41    42    35.00000  120.00000
   46    50    51    70.00000  120.00000
   46    50    61    63.00000  120.00000
   46    52    53    80.00000  117.50000
   46    52    54    80.00000  117.50000
   50    61    70    63.00000  120.00000
   50    61    72    70.00000  120.00000
   61    50    51    70.00000  120.00000
   61    70    71    35.00000  120.00000
   61    72    73    35.00000  113.00000
   70    38    41    63.00000  120.00000
   72    61    70    70.00000  120.00000
   52    46    50    85.00000  120.00000
   54    52    53    80.00000  125.30000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  112.17500
   39    43    47    30.00000  179.48800
   39    44    45    80.00000  120.40000
   39    44    49    70.00000  116.60000
   43    39    40    35.00000  108.50000
   43    47    48    20.00000  179.85100
   44    39    40    35.00000  109.50000
   44    39    43    70.00000  111.78000
   44    49    55    50.00000  121.90000
   44    49    58    50.00000  121.90000
   49    44    45    80.00000  122.90000
   49    55    56    35.00000  109.50000
   49    55    57    35.00000  109.50000
   49    55    62    70.00000  110.72300
   49    58    59    35.00000  109.50000
   49    58    60    35.00000  109.50000
   49    58    66    70.00000  110.72300
   55    62    63    37.50000  110.70000
   55    62    64    37.50000  110.70000
   55    62    65    37.50000  110.70000
   57    55    56    33.00000  107.80000
   62    55    56    37.50000  110.70000
   62    55    57    37.50000  110.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   58    49    55    50.00000  118.00000
   58    66    67    37.50000  110.70000
   58    66    68    37.50000  110.70000
   58    66    69    37.50000  110.70000
   60    58    59    33.00000  107.80000
   66    58    59    37.50000  110.70000
   66    58    60    37.50000  110.70000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.23050  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    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    70  -0.16000  1.0 1.0
   29    33    38    70  -0.03200 -1.0 2.0
   29    33    38    70   0.04500  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  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    41    42   3.62500 -1.0 2.0
   33    38    41    46   3.62500 -1.0 2.0
   33    38    70    61   3.62500 -1.0 2.0
   33    38    70    71   3.62500 -1.0 2.0
   33    39    43    47   0.00000  1.0 1.0
   33    39    44    45   0.30150 -1.0 2.0
   33    39    44    49   1.39750  1.0 1.0
   33    39    44    49  -0.07950 -1.0 2.0
   33    39    44    49  -0.18750  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    70   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    43   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    43   0.56750  1.0 1.0
   38    33    39    43  -0.07550 -1.0 2.0
   38    33    39    43   0.20000  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    41    46    50   3.62500 -1.0 2.0
   38    41    46    52   3.62500 -1.0 2.0
   41    38    70    61   3.62500 -1.0 2.0
   41    38    70    71   3.62500 -1.0 2.0
   41    46    50    51   3.62500 -1.0 2.0
   41    46   -50    61   3.62500 -1.0 2.0
   41    46    52    53   0.69950 -1.0 2.0
   41    46    52    54   0.69950 -1.0 2.0
   42    41    46    50   3.62500 -1.0 2.0
   42    41    46    52   3.62500 -1.0 2.0
   46    50    61    70   3.62500 -1.0 2.0
   46    50    61    72   3.62500 -1.0 2.0
   50    46    52    53   0.69950 -1.0 2.0
   50    46    52    54   0.69950 -1.0 2.0
   50    61   -70    38   3.62500 -1.0 2.0
   50    61    70    71   3.62500 -1.0 2.0
   50    61    72    73   0.84100 -1.0 2.0
   51    50    61    70   3.62500 -1.0 2.0
   51    50    61    72   3.62500 -1.0 2.0
   70    38    41    42   3.62500 -1.0 2.0
   70    38   -41    46   3.62500 -1.0 2.0
   70    61    72    73   0.84100 -1.0 2.0
   72    61    70    38   3.62500 -1.0 2.0
   72    61    70    71   3.62500 -1.0 2.0
   52    46    50    51   3.62500 -1.0 2.0
   52    46    50    61   3.62500 -1.0 2.0
   39    33    38    41   0.04150 -1.0 2.0
   39    33    38    70   0.04150 -1.0 2.0
   39    43    47    48   0.00000  1.0 1.0
   39    44    49    55   1.49850  1.0 1.0
   39    44    49    55   1.53950 -1.0 2.0
   39    44    49    58   1.49850  1.0 1.0
   39    44    49    58   1.53950 -1.0 2.0
   40    39    43    47   0.00000  1.0 1.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    49   0.00000  1.0 1.0
   43    39    44    45   0.30150 -1.0 2.0
   43    39    44    49   0.00000  1.0 1.0
   44    39    43    47   0.00000  1.0 1.0
   44    49    55    56   0.00000  1.0 1.0
   44    49    55    57   0.00000  1.0 1.0
   44    49    55    62  -0.43950  1.0 1.0
   44    49    55    62  -0.08100 -1.0 2.0
   44    49    55    62   0.03350  1.0 3.0
   44    49    58    59   0.00000  1.0 1.0
   44    49    58    60   0.00000  1.0 1.0
   44    49    58    66  -0.43950  1.0 1.0
   44    49    58    66  -0.08100 -1.0 2.0
   44    49    58    66   0.03350  1.0 3.0
   45    44    49    55   3.04450 -1.0 2.0
   45    44    49    58   3.04450 -1.0 2.0
   49    55    62    63   0.15000  1.0 3.0
   49    55    62    64   0.15000  1.0 3.0
   49    55    62    65   0.15000  1.0 3.0
   49    58    66    67   0.15000  1.0 3.0
   49    58    66    68   0.15000  1.0 3.0
   49    58    66    69   0.15000  1.0 3.0
   55    49    58    59   0.00000  1.0 1.0
   55    49    58    60   0.00000  1.0 1.0
   55    49    58    66  -0.05900 -1.0 2.0
   56    55    62    63   0.15000  1.0 3.0
   56    55    62    64   0.15000  1.0 3.0
   56    55    62    65   0.15000  1.0 3.0
   57    55    62    63   0.15000  1.0 3.0
   57    55    62    64   0.15000  1.0 3.0
   57    55    62    65   0.15000  1.0 3.0
   58    49    55    56   0.00000  1.0 1.0
   58    49    55    57   0.00000  1.0 1.0
   58    49    55    62  -0.05900 -1.0 2.0
   59    58    66    67   0.15000  1.0 3.0
   59    58    66    68   0.15000  1.0 3.0
   59    58    66    69   0.15000  1.0 3.0
   60    58    66    67   0.15000  1.0 3.0
   60    58    66    68   0.15000  1.0 3.0
   60    58    66    69   0.15000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   41    70    38    33   4.00000 -1.0 2.0
   46    42    41    38   1.10000 -1.0 2.0
   50    52    46    41   4.00000 -1.0 2.0
   61    51    50    46   4.00000 -1.0 2.0
   70    72    61    50   4.00000 -1.0 2.0
   61    71    70    38   1.10000 -1.0 2.0
   53    46    52    54  10.50000 -1.0 2.0
   39    49    44    45  10.50000 -1.0 2.0
   58    44    49    55   1.00000 -1.0 2.0
END
