* LIGAND DATABASE FILE (OPLS2005)
*
001      98   103    197    325     586
    1     0 S   NP   _N1_     1    28.36142    98.64526   -21.05156
    2     1 S   H    _HN1     2     1.02787   102.61952  -126.64009
    3     1 S   H    _H1_     3     1.02854    67.28801   -21.90744
    4     1 S   H    _H2_     4     1.02968    44.39511   130.69077
    5     1 S   CT   _CA1     5     1.50603   142.99098    73.72032
    6     5 S   HC   _HA1     6     1.09678   104.53888   102.40395
    7     5 S   CO3  _C1_     7     1.54389   110.78631   -13.23691
    8     7 S   O2Z  _O11     8     1.25978   116.80854  -121.74528
    9     7 S   O2Z  _O12     9     1.26611   113.66759    57.33956
   10     5 S   CT   _CB1    10     1.53069   106.91255  -141.62721
   11    10 S   HC   HB11    11     1.09846   109.79675   -41.98243
   12    10 S   HC   HB12    12     1.09782   110.17034    74.57323
   13    10 S   CT   _CG1    13     1.53089   112.65741  -162.62201
   14    13 S   HC   HG11    14     1.09425   110.96146   -60.16423
   15    13 S   HC   HG12    15     1.09660   109.87375    58.97778
   16    13 S   C    _CD1    16     1.51846   111.98650   179.13408
   17    16 S   O    _OE1    17     1.22777   123.21795    -0.88116
   18    16 S   N    _N2_    18     1.38556   111.91294   179.26405
   19    18 S   H    _HN2    19     1.01548   119.14641     4.55509
   20    18 S   CT1  _CA2    20     1.45906   122.63492   178.33305
   21    20 S   HC   _HA2    21     1.09716   108.88601    24.93376
   22    20 S   C    _C2_    22     1.52880   106.83740   -92.34640
   23    22 S   O    _O2_    23     1.23003   122.92107   -28.95636
   24    20 S   CT   _CB2    32     1.53127   112.39030   148.02405
   25    24 S   HC   HB21    33     1.09592   109.99945    57.05836
   26    24 S   HC   HB22    34     1.09508   110.22341   175.96124
   27    22 S   N    _N3_    24     1.38467   112.69512   153.86059
   28    27 S   H    _HN3    25     1.01666   120.40588    -2.17646
   29    24 S   S    _SG2    35     1.82570   111.22006   -63.41574
   30    27 S   CT   _CA3    26     1.45357   122.35917   178.57852
   31    30 S   HC   HA31    27     1.09572   107.64982   -58.37530
   32    30 S   HC   HA32    28     1.09566   107.73597    57.90874
   33    29 S   CT   _C26    36     1.85264    99.54902   177.10924
   34    33 S   HC   _H7_    37     1.09556   105.47690   -28.69367
   35    30 S   CO3  _C3_    29     1.52863   114.43338   179.69674
   36    35 S   O2Z  _O31    30     1.26312   116.09685    -3.56623
   37    35 S   O2Z  _O32    31     1.26448   114.39175   176.49189
   38    33 S   CM   _C25    38     1.51082   108.25688    81.99767
   39    38 S   HC   _H23    39     1.09180   113.99368  -106.18095
   40    33 S   CT   _C9_    82     1.59476   115.87379  -145.14789
   41    38 S   CMA  _C24    40     1.35066   128.37456    75.35863
   42    41 S   OM   _O39    41     1.26585   124.40148  -179.57433
   43    40 S   CT   _C29    83     1.55003   106.40901   173.40278
   44    43 S   HC   _H30    84     1.09003   112.84185   149.66828
   45    43 S   HC   _H31    85     1.09353   113.07486    30.56272
   46    43 S   HC   _H32    86     1.09431   111.58989   -87.82414
   47    41 S   OS   _O38    42     1.39487   113.85294    -4.48637
   48    47 S   CT   _C23    43     1.44394   118.30910    77.60499
   49    48 S   CT   _C10    44     1.57252   109.16591   -90.81663
   50    49 S   HC   _H4_    45     1.10139   104.06309   -53.90582
   51    48 S   CT   _C27    91     1.55115   101.57108   153.17023
   52    51 S   HC   _H24    92     1.09745   110.56552   -51.58287
   53    51 S   HC   _H25    93     1.09406   112.80089  -171.80583
   54    51 S   HC   _H26    94     1.09629   111.02130    65.81528
   55    48 S   CT   _C28    95     1.53972   114.04314    40.01456
   56    55 S   HC   _H27    96     1.09706   110.52972    56.41743
   57    55 S   HC   _H28    97     1.09063   113.26628   -61.74687
   58    55 S   HC   _H29    98     1.09448   111.69425   176.11607
   59    49 S   CT   _C11    46     1.54549   112.50776  -166.26078
   60    59 S   HC   _H15    47     1.09462   110.62575    51.95074
   61    59 S   HC   _H16    48     1.09189   112.58744   -66.76487
   62    59 S   CO4  _C12    49     1.52041   111.80798   169.21352
   63    62 S   O    _O33    50     1.23079   120.42059  -122.81531
   64    62 S   CT   _C13    51     1.52879   116.71006    58.25001
   65    64 S   CT   _C8_    52     1.57704   104.16764   -54.64458
   66    65 S   HC   _H3_    53     1.09073   105.53236   -56.32338
   67    64 S   CT   _C22    87     1.55020   107.20038    67.67853
   68    67 S   HC   _H20    88     1.09441   111.86543  -172.37383
   69    67 S   HC   _H21    89     1.09735   110.95819    67.76420
   70    67 S   HC   _H22    90     1.08656   114.51061   -49.05280
   71    65 S   CT   _C7_    54     1.53191   108.52331  -167.45686
   72    71 S   HC   _H13    55     1.09566   110.29722   -55.39631
   73    71 S   HC   _H14    56     1.09122   113.21375  -173.16316
   74    71 S   CT   _C6_    57     1.53927   111.53876    66.12558
   75    74 S   HC   _H11    58     1.09798   108.64833    98.25335
   76    74 S   HC   _H12    59     1.09771   105.90602  -148.79585
   77    74 S   CT   _C5_    60     1.55843   116.75746   -25.73224
   78    77 S   CT   _C17    61     1.57790   108.91813  -147.54137
   79    78 S   HC   _H6_    62     1.09948   109.96549    57.14252
   80    77 S   CT   _C4_    78     1.55298   112.70156    92.51724
   81    80 S   HC   _H8_    79     1.09595   111.38547   165.87249
   82    80 S   HC   _H9_    80     1.09421   111.35842    45.80320
   83    80 S   HC   _H10    81     1.09033   114.16449   -75.71417
   84    78 S   C5BC _C18    63     1.50690   114.50427   -62.10438
   85    78 S   OS   _O36    71     1.45524   111.14936   173.57752
   86    84 S   C5BC _C19    64     1.42522   127.82030   -90.81250
   87    86 S   HA   _H17    65     1.08126   127.39221     0.79623
   88    85 S   CO4  _C16    72     1.36419   121.74987   -47.52275
   89    88 S   O    _O35    73     1.22456   122.31291  -169.95002
   90    86 S   C5A  _C20    66     1.37423   106.70721  -179.29252
   91    90 S   HA   _H18    67     1.08021   133.73746  -179.90935
   92    88 S   C3T  _C15    74     1.47739   117.29125    11.85614
   93    92 S   HC   _H5_    75     1.08332   115.14113   167.71138
   94    90 S   OA   _O37    68     1.35612   110.47532     0.38206
   95    64 S   C3T  _C14    76     1.57309   112.48730  -173.21910
   96    84 S   C5A  _C21    69     1.38206   127.24177    90.97168
   97    96 S   HA   _H19    70     1.08066   133.45743    -0.70443
   98    92 S   O3T  _O34    77     1.42686   114.39769   -53.07288
  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
  19   7   2   1   1   9   4  24   6   2  11   4   3   2  12  15
  18   7   8   3   2   1   4   2   1   1   8   4   3  13   4  18
  15   6   8   3   2   1   9   5   4  14   5   4  15  18   7   8
   3   2   1  10   8   6   4   5   4   4   2   3   2   2   1   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    49    65    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    47    48    49    50    59    64    65    66    71    40    43    44    45    46  
   38    39    41    49    65    40    43  
   36    37  
   37  
    0  
   39    41    42    47    48    49    65    40    43  
   41    42    47    40  
   43    44    45    46    67    51    55    41    47    48    49    50    59    60    61    62    64    65    66    71    72    73    74    95  
   42    47    48    49    51    55  
   47    48  
   44    45    46    48    49    50    59    64    65    66    71  
   45    46    49    65  
   46    49    65  
   49    65  
   48    49    50    59    51    52    53    54    55    56    57    58  
   49    50    59    60    61    62    65    51    52    53    54    55    56    57    58  
   50    59    60    61    62    63    64    65    66    71    51    52    53    54    55    56    57    58  
   59    60    61    62    65    51    55  
   52    53    54    55    56    57    58    59  
   53    54    55  
   54    55  
   55  
   56    57    58    59  
   57    58  
   58  
    0  
   60    61    62    63    64    65    95    67  
   61    62    63    64  
   62    63    64  
   63    64    65    66    71    77    92    95    98    67    68    69    70  
   64    65    95    67  
   65    66    71    72    73    74    77    78    88    92    93    95    98    80    67    68    69    70  
   66    71    72    73    74    75    76    77    92    95    98    67    68    69    70  
   71    72    73    74    95    67  
   68    69    70    71    77    92    95    98  
   69    70    95  
   70    95  
   95  
   72    73    74    75    76    77    78    95    80  
   73    74    75    76    77  
   74    75    76    77  
   75    76    77    78    79    84    85    92    95    98    80    81    82    83  
   76    77    78    95    80  
   77    78    95    80  
   78    79    84    86    96    85    88    92    93    95    98    80    81    82    83  
   79    84    86    87    90    94    96    97    85    88    89    92    95    98    80    81    82    83  
   84    86    96    85    88    95    80  
   81    82    83    84    85    92    95    98  
   82    83    95  
   83    95  
   95  
   86    87    90    91    94    96    97    85    88    95  
   88    89    92    93    95    98    86    96  
   87    90    91    94    96    97  
   90    91    94    96  
   89    92    93    95    98  
   92    93    95    98  
   91    94    96    97  
   94    96  
   93    95    98  
   95    98  
   96    97  
   98  
   97  
    0  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   39   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   48   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   61   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   62   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   64   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   65   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   78   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   80   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   85   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   86   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   87   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   88   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   89   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   90   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   91   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   92   3.5000   0.0660   0.116200   1.9750   1.7500   0.005000000  -0.741685710
   93   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   94   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   95   3.5000   0.0660   0.176200   1.9750   1.7500   0.005000000  -0.741685710
   96   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   97   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   98   2.9000   0.1400  -0.352400   1.5900   1.4000   0.020110767  -0.896042159
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    40   268.000  1.529
   38    39   340.000  1.080
   38    41   465.000  1.376
   41    42   745.000  1.250
   41    47   440.000  1.360
   47    48   320.000  1.410
   48    49   268.000  1.529
   48    51   268.000  1.529
   48    55   268.000  1.529
   49    50   340.000  1.090
   49    59   268.000  1.529
   49    40   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   317.000  1.522
   62    63   570.000  1.229
   62    64   317.000  1.522
   64    65   268.000  1.529
   64    95   275.000  1.510
   64    67   268.000  1.529
   65    66   340.000  1.090
   65    71   268.000  1.529
   65    40   268.000  1.529
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   268.000  1.529
   74    75   340.000  1.090
   74    76   340.000  1.090
   74    77   268.000  1.529
   77    78   268.000  1.529
   77    95   275.000  1.510
   77    80   268.000  1.529
   78    79   340.000  1.090
   78    84   285.000  1.502
   78    85   320.000  1.410
   84    86   469.000  1.424
   84    96   546.000  1.367
   86    87   367.000  1.080
   86    90   546.000  1.367
   90    91   367.000  1.080
   90    94   340.000  1.360
   94    96   340.000  1.360
   96    97   367.000  1.080
   85    88   214.000  1.327
   88    89   570.000  1.229
   88    92   290.000  1.496
   92    93   340.000  1.088
   92    95   260.000  1.509
   92    98   335.000  1.432
   95    98   335.000  1.432
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    83   340.000  1.090
   40    43   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    40    75.00000  111.63000
   33    38    39    35.00000  117.00000
   33    38    41    70.00000  124.00000
   33    40    49    58.35000  112.70000
   33    40    65    58.35000  112.70000
   33    40    43    58.35000  112.70000
   38    33    34    35.00000  109.50000
   38    41    42    65.00000  137.10300
   38    41    47    80.00000  120.01400
   41    38    39    40.00000  120.50800
   41    47    48    90.00000  111.18400
   47    41    42    65.00000  121.00000
   47    48    49    50.00000  109.50000
   47    48    51    50.00000  109.50000
   47    48    55    50.00000  109.50000
   48    49    50    37.50000  110.70000
   48    49    59    58.35000  112.70000
   48    49    40    58.35000  112.70000
   48    51    52    37.50000  110.70000
   48    51    53    37.50000  110.70000
   48    51    54    37.50000  110.70000
   48    55    56    37.50000  110.70000
   48    55    57    37.50000  110.70000
   48    55    58    37.50000  110.70000
   49    59    60    37.50000  110.70000
   49    59    61    37.50000  110.70000
   49    59    62    63.00000  111.10000
   49    40    65    58.35000  112.70000
   49    40    43    58.35000  112.70000
   59    49    50    37.50000  110.70000
   59    62    63    80.00000  120.40000
   59    62    64    70.00000  116.00000
   61    59    60    33.00000  107.80000
   62    59    60    35.00000  109.50000
   62    59    61    35.00000  109.50000
   62    64    65    63.00000  111.10000
   62    64    95    63.00000  111.10000
   62    64    67    63.00000  111.10000
   64    62    63    80.00000  120.40000
   64    65    66    37.50000  110.70000
   64    65    71    58.35000  112.70000
   64    65    40    58.35000  112.70000
   64    95    77    58.35000  112.70000
   64    95    92    60.00000  120.94000
   64    95    98    80.00000  116.47100
   64    67    68    37.50000  110.70000
   64    67    69    37.50000  110.70000
   64    67    70    37.50000  110.70000
   65    71    72    37.50000  110.70000
   65    71    73    37.50000  110.70000
   65    71    74    58.35000  112.70000
   65    40    43    58.35000  112.70000
   71    65    66    37.50000  110.70000
   71    74    75    37.50000  110.70000
   71    74    76    37.50000  110.70000
   71    74    77    58.35000  112.70000
   73    71    72    33.00000  107.80000
   74    71    72    37.50000  110.70000
   74    71    73    37.50000  110.70000
   74    77    78    58.35000  112.70000
   74    77    95    70.00000  112.37300
   74    77    80    58.35000  112.70000
   76    74    75    33.00000  107.80000
   77    74    75    37.50000  110.70000
   77    74    76    37.50000  110.70000
   77    78    79    37.50000  110.70000
   77    78    84    70.00000  112.17500
   77    78    85    50.00000  109.50000
   77    95    92    60.00000  120.94000
   77    95    98    80.00000  116.47100
   77    80    81    37.50000  110.70000
   77    80    82    37.50000  110.70000
   77    80    83    37.50000  110.70000
   78    84    86    60.00000  130.00000
   78    84    96    60.00000  130.00000
   78    85    88    83.00000  116.90000
   84    78    79    35.00000  109.50000
   84    86    87    35.00000  127.50000
   84    86    90    70.00000  107.30000
   84    96    94    70.00000  110.60000
   84    96    97    35.00000  132.10000
   86    90    91    35.00000  132.10000
   86    90    94    70.00000  110.60000
   90    86    87    35.00000  125.70000
   90    94    96    70.00000  106.50000
   94    90    91    35.00000  113.40000
   94    96    97    35.00000  113.40000
   96    84    86    70.00000  107.30000
   85    78    79    35.00000  109.50000
   85    78    84    85.00000  111.85700
   85    88    89    83.00000  123.40000
   85    88    92    81.00000  111.40000
   88    92    93    40.00000  116.18000
   88    92    95    65.00000  117.18000
   88    92    98    80.00000  114.91000
   92    88    89    75.00000  121.36600
   92    95    98    15.00000   60.43100
   92    98    95    15.00000   59.14900
   95    64    65    70.00000  112.37300
   95    77    78    70.00000  112.37300
   95    92    93    37.50000  117.20000
   98    92    93    50.00000  114.27700
   98    92    95    15.00000   60.43100
   80    77    78    58.35000  112.70000
   80    77    95    70.00000  112.37300
   82    80    81    33.00000  107.80000
   83    80    81    33.00000  107.80000
   83    80    82    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    49    50    37.50000  110.70000
   40    49    59    58.35000  112.70000
   40    65    66    37.50000  110.70000
   40    65    71    58.35000  112.70000
   40    43    44    37.50000  110.70000
   40    43    45    37.50000  110.70000
   40    43    46    37.50000  110.70000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
   67    64    65    58.35000  112.70000
   67    64    95    70.00000  112.37300
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   51    48    49    58.35000  112.70000
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    33.00000  107.80000
   55    48    49    58.35000  112.70000
   55    48    51    58.35000  112.70000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    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  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.00000  1.0 1.0
   29    33    38    41   0.42700  1.0 1.0
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   67    64    95    77  -0.07550 -1.0 2.0
   67    64    95    77   0.20000  1.0 3.0
   67    64    95    92   0.07850  1.0 1.0
   67    64    95    92  -0.03950 -1.0 2.0
   67    64    95    92   0.67350  1.0 3.0
   67    64    95    98   0.02550  1.0 1.0
   67    64    95    98  -0.02600 -1.0 2.0
   67    64    95    98   1.20400  1.0 3.0
   51    48    49    50   0.15000  1.0 3.0
   51    48    49    59   0.56750  1.0 1.0
   51    48    49    59  -0.07550 -1.0 2.0
   51    48    49    59   0.20000  1.0 3.0
   51    48    49    40   0.56750  1.0 1.0
   51    48    49    40  -0.07550 -1.0 2.0
   51    48    49    40   0.20000  1.0 3.0
   51    48    55    56   0.15000  1.0 3.0
   51    48    55    57   0.15000  1.0 3.0
   51    48    55    58   0.15000  1.0 3.0
   55    48    49    50   0.15000  1.0 3.0
   55    48    49    59   0.56750  1.0 1.0
   55    48    49    59  -0.07550 -1.0 2.0
   55    48    49    59   0.20000  1.0 3.0
   55    48    49    40   0.56750  1.0 1.0
   55    48    49    40  -0.07550 -1.0 2.0
   55    48    49    40   0.20000  1.0 3.0
   55    48    51    52   0.15000  1.0 3.0
   55    48    51    53   0.15000  1.0 3.0
   55    48    51    54   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
   33    39    38    41   1.10000 -1.0 2.0
   42    47    41    38   1.10000 -1.0 2.0
   59    64    62    63  10.50000 -1.0 2.0
   86    96    84    78   4.00000 -1.0 2.0
   90    87    86    84   1.10000 -1.0 2.0
   94    91    90    86   1.10000 -1.0 2.0
   94    97    96    84   1.10000 -1.0 2.0
   85    92    88    89  10.50000 -1.0 2.0
END
