* LIGAND DATABASE FILE (OPLS2005)
*
001     112   113    203    313     606
    1     0 S   NP   _N1_     1    29.81206    92.74685   -27.24624
    2     1 S   H    _HN1     2     1.02827    21.21276  -133.24142
    3     1 S   H    _H1_     3     1.02785   127.52135  -108.44681
    4     1 S   H    _H2_     4     1.02952    91.22193     5.96621
    5     1 S   CT   _CA1     5     1.50113   104.82813   117.45701
    6     5 S   HC   _HA1     6     1.09572   105.21210    80.62179
    7     5 S   CO3  _C1_     7     1.53793   112.45091   -39.63948
    8     7 S   O2Z  _O11     8     1.26372   115.01305   -42.88191
    9     7 S   O2Z  _O12     9     1.26240   114.94403   136.28214
   10     5 S   CT   _CB1    10     1.53076   107.41670  -161.39290
   11    10 S   HC   HB11    11     1.09832   109.38359   -49.80739
   12    10 S   HC   HB12    12     1.09817   110.43418    66.79112
   13    10 S   CT   _CG1    13     1.52989   112.61961  -170.80660
   14    13 S   HC   HG11    14     1.09584   110.59134   -64.85419
   15    13 S   HC   HG12    15     1.09664   109.85384    54.40771
   16    13 S   C    _CD1    16     1.51768   112.22385   174.83684
   17    16 S   O    _OE1    17     1.22716   123.29923     4.43535
   18    16 S   N    _N2_    18     1.38654   111.69676  -175.64751
   19    18 S   H    _HN2    19     1.01590   118.93156     2.18140
   20    18 S   CT1  _CA2    20     1.46063   123.37636   178.21502
   21    20 S   HC   _HA2    21     1.09561   109.41049     2.62912
   22    20 S   C    _C2_    22     1.53568   109.04075  -112.49271
   23    22 S   O    _O2_    23     1.23073   122.11196  -150.02092
   24    20 S   CT   _CB2    32     1.53300   111.60753   125.09308
   25    24 S   HC   HB21    33     1.09698   109.28506    62.73137
   26    24 S   HC   HB22    34     1.09453   111.14113   179.15304
   27    22 S   N    _N3_    24     1.38277   113.83173    37.47840
   28    27 S   H    _HN3    25     1.01584   119.59017    -3.33912
   29    24 S   S    _SG2    35     1.83092   115.28896   -56.50120
   30    27 S   CT   _CA3    26     1.45286   123.20984   177.03271
   31    30 S   HC   HA31    27     1.09550   107.51200   -64.48055
   32    30 S   HC   HA32    28     1.09557   107.98305    51.95847
   33    29 S   CT   _C21    36     1.84223   101.78071   -59.53448
   34    33 S   HC   _H10    37     1.09330   108.73039    57.05901
   35    30 S   CO3  _C3_    29     1.52959   114.07802   173.95597
   36    35 S   O2Z  _O31    30     1.26375   116.05915    -0.67724
   37    35 S   O2Z  _O32    31     1.26427   114.41521   179.38579
   38    33 S   CT1  _C10    38     1.54584   112.30508   -65.70790
   39    38 S   HC   _H5_    39     1.09637   110.34730    54.18155
   40    33 S   N    _N13   106     1.46151   106.10197   172.00584
   41    40 S   H    _H32   107     1.01324   117.40435    32.58391
   42    38 S   C    _C11    40     1.53140   110.16128   168.82573
   43    42 S   O    _O35    41     1.23160   120.38056   -68.38294
   44    38 S   N    _N5_    69     1.46023   111.80737   -65.17335
   45    44 S   H    _H17    70     1.01561   117.57780   -30.07170
   46    40 S   C    _C22   108     1.38177   124.01415  -144.54422
   47    46 S   O    _O38   109     1.22795   125.28545     0.31959
   48    42 S   N    _N6_    42     1.38308   115.29324   107.29850
   49    48 S   H    _H18    43     1.01635   118.55949     5.91762
   50    46 S   N    _N14   110     1.37728   112.15206  -179.26166
   51    50 S   H    _H33   111     1.01298   122.15177    -1.09932
   52    50 S   H    _H34   112     1.01366   120.45790  -179.65338
   53    48 S   CT1  _C12    44     1.46314   123.07727  -177.08664
   54    53 S   HC   _H6_    45     1.09838   107.53241     1.26176
   55    53 S   C    _C13    46     1.53917   110.95275  -112.87554
   56    55 S   O    _O36    47     1.23105   121.91642  -159.39116
   57    53 S   CT   _C17    90     1.54678   110.45326   118.72451
   58    57 S   HC   _H8_    91     1.09840   107.02505   -53.14799
   59    55 S   N    _N7_    48     1.38360   114.18743    27.60695
   60    59 S   H    _H19    49     1.01590   118.68182    -4.34663
   61    57 S   CT   _C18    92     1.52847   113.12929    65.72029
   62    61 S   HC   _H25    93     1.09527   112.27493    43.28641
   63    61 S   HC   _H26    94     1.09525   110.49166   -76.44806
   64    59 S   CT   _C14    50     1.45518   123.71245   172.30140
   65    64 S   HC   _H20    51     1.09647   107.32920   -56.63317
   66    64 S   HC   _H21    52     1.09651   106.31295  -171.93910
   67    61 S   CD   _C19    95     1.50401   112.62625   163.27829
   68    67 S   HC   _H27    96     1.10289   116.16838   172.19619
   69    64 S   CT1  _C15    53     1.53250   113.83751    65.55091
   70    69 S   HC   _H7_    54     1.09504   110.41543   -63.22261
   71    67 S   NI   _N10    97     1.28722   125.58648   -10.25352
   72    69 S   C    _C16    55     1.52612   110.20946    58.63781
   73    72 S   O    _O37    56     1.22900   122.60457    73.76533
   74    69 S   NT   _N9_    87     1.46506   110.28621   177.56072
   75    74 S   H    _H23    88     1.01952   109.65269   176.89058
   76    74 S   H    _H24    89     1.01931   109.66121    60.57108
   77    71 S   CT   _C20    98     1.46237   117.47642     2.87678
   78    77 S   HC   _H9_    99     1.09681   107.64425    96.55165
   79    72 S   N    _N8_    57     1.38831   112.29113  -104.74994
   80    79 S   H    _H22    58     1.01517   118.37946     0.10279
   81    57 S   NT   _N11   100     1.46829   111.32807  -170.21114
   82    81 S   H    _H28   101     1.02114   108.94230   -65.88812
   83    77 S   NP   _N12   102     1.48376   110.48976  -151.20726
   84    83 S   H    _H29   103     1.02673   110.83816  -176.79350
   85    83 S   H    _H30   104     1.02611   110.44765    63.29013
   86    83 S   H    _H31   105     1.02673   110.77196   -56.20079
   87    79 S   CT1  _C6_    59     1.45720   125.33977   178.72252
   88    87 S   HC   _H3_    60     1.09877   105.03280   170.56335
   89    87 S   C    _C7_    61     1.52793   108.36403   -77.13561
   90    89 S   O    _O33    62     1.23144   121.22888   -96.53804
   91    87 S   CT   _C5_    80     1.53377   115.56649    52.56855
   92    91 S   HC   _H14    81     1.09730   108.98515  -176.50206
   93    91 S   HC   _H15    82     1.09442   112.04193   -59.47576
   94    89 S   N    _N4_    63     1.38153   114.64210    80.03645
   95    94 S   H    _H16    64     1.01674   119.14699    -7.04996
   96    91 S   CT   _C4_    83     1.52292   112.33352    63.08601
   97    96 S   HC   _H11    84     1.09437   111.33449   -63.05700
   98    96 S   HC   _H12    85     1.09467   110.10714   177.35544
   99    96 S   HC   _H13    86     1.09464   111.04053    57.83022
  100    94 S   CT1  _C8_    65     1.45499   122.91202   177.11235
  101   100 S   HC   _H4_    66     1.09692   108.73913   -33.54521
  102   100 S   C    _C9_    67     1.52658   106.59781    85.15890
  103   102 S   O    _O34    68     1.22901   122.86308    72.36766
  104   100 S   CT   _C23    71     1.53577   111.57515  -155.02455
  105   104 S   HC   _H35    72     1.09766   109.89935   -56.11445
  106   104 S   HC   _H36    73     1.09741   109.16250  -173.75895
  107   104 S   NT   _N15    74     1.46594   110.69742    64.98576
  108   107 S   H    _H37    75     1.01970   109.63769    58.60942
  109   107 S   CT   _C24    76     1.45652   111.07452   179.52687
  110   109 S   HC   _H38    77     1.09478   111.20591    60.91151
  111   109 S   HC   _H39    78     1.09484   111.51516   -61.14817
  112   109 S   HC   _H40    79     1.09438   109.44123   179.51302
  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  14   7   8   3  10   4   8   3   4   3  10
   4   2   1   1  15   7  11   4  13   7   8   4   8   5   4  10
   5   4   6   2   9   6   8  10   4   3   1   1   7   6  10   4
   5   1   3   2   1   1  13   7  11   4   7   5   4   9   4   3
   2   1   1   9   6   5   1   8   4   3   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    44    40    41    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    48   102    44    45    40    41    46    47    50  
   38    39    42    44    40    41    46  
   36    37  
   37  
    0  
   39    42    43    48    49    53   100   102   103    44    45    40    41    46  
   42    43    48   102    44    45    40  
   41    46    47    50    51    52    42    44  
   46    47    50  
   43    48    49    53    54    55   102    44    45    57  
   48    49    53    44  
   45   104    48    94   100   101   102   103  
  100   102   103  
   47    50    51    52  
   50    51    52  
   49    53    54    55    56    59    57    58    61    81  
   53    54    55    57  
   51    52  
   52  
    0  
   54    55    56    59    60    64    57    58    61    62    63    67    77    81    82  
   55    56    59    57    58    61    81  
   56    59    60    64    65    66    69    57    58    61    81  
   59    60    64    57  
   58    61    62    63    67    68    71    77    78    81    82    83    59  
   61    62    63    67    77    81    82  
   60    64    65    66    69    70    72    74  
   64    65    66    69  
   62    63    67    68    71    77    81    82  
   63    67    68    71    81  
   67    68    71    81  
   65    66    69    70    72    73    79    74    75    76  
   66    69    70    72    74  
   69    70    72    74  
   68    71    77    78    81    83  
   71    77  
   70    72    73    79    80    87    74    75    76  
   72    73    79    74    75    76  
   77    78    81    82    83    84    85    86  
   73    79    80    87    88    89    91    74    75    76  
   79    80    87    74  
   75    76    79  
   76  
    0  
   78    81    82    83    84    85    86  
   81    82    83    84    85    86  
   80    87    88    89    90    94    91    92    93    96  
   87    88    89    91  
   82    83    84    85    86  
   83  
   84    85    86  
   85    86  
   86  
    0  
   88    89    90    94    95   100    91    92    93    96    97    98    99  
   89    90    94    91    92    93    96  
   90    94    95   100   101   102   104    91    92    93    96  
   94    95   100    91  
   92    93    96    97    98    99    94  
   93    96    97    98    99  
   96    97    98    99  
   95   100   101   102   103   104   105   106   107  
  100   101   102   104  
   97    98    99  
   98    99  
   99  
    0  
  101   102   103   104   105   106   107   108   109  
  102   103   104   105   106   107  
  103   104   105   106   107  
  104  
  105   106   107   108   109   110   111   112  
  106   107   108   109  
  107   108   109  
  108   109   110   111   112  
  109   110   111   112  
  110   111   112  
  111   112  
  112  
    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   0.259500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.3810   1.2100   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   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   40   3.2500   0.1700  -0.518100   2.1120   1.8750   0.051222218  -2.220205820
   41   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   42   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   44   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   45   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   46   3.7500   0.1050   0.822000   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.616300   1.8100   1.6000   0.001000000  -1.480495490
   48   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   49   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   50   3.2500   0.1700  -0.959200   1.8100   1.6000   0.054801302  -1.445846770
   51   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   52   0.5000   0.0300   0.414200   1.5900   1.4000   0.030040813  -0.651083722
   53   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   55   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   57   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   60   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   61   3.5000   0.0660  -0.083900   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   67   3.7500   0.1050   0.313400   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.040200   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660   0.163900   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   72   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   73   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   74   3.3000   0.1700  -0.943900   1.8650   1.6500   0.051222218  -2.220205820
   75   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   76   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   77   3.5000   0.0660   0.495000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0150   0.060000   1.6450   1.4500   0.008598240   0.268726247
   79   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   80   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   81   3.3000   0.1700  -0.702500   2.1120   1.8750   0.051222218  -2.220205820
   82   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   83   3.2500   0.1700  -0.300000   2.2900   2.0360   0.003973653   1.685851020
   84   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   85   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   86   0.5000   0.0300   0.330000   0.9960   0.8600   0.030040813  -0.651083722
   87   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   90   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   91   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   94   3.2500   0.1700  -0.500000   2.1120   1.8750   0.051222218  -2.220205820
   95   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   96   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
  102   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
  103   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  104   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   3.3000   0.1700  -0.780000   2.1120   1.8750   0.051222218  -2.220205820
  108   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
  109   3.5000   0.0660   0.020000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   268.000  1.529
   33    40   337.000  1.449
   38    39   340.000  1.090
   38    42   317.000  1.522
   38    44   337.000  1.449
   42    43   570.000  1.229
   42    48   490.000  1.335
   48    49   434.000  1.010
   48    53   337.000  1.449
   53    54   340.000  1.090
   53    55   317.000  1.522
   53    57   268.000  1.529
   55    56   570.000  1.229
   55    59   490.000  1.335
   59    60   434.000  1.010
   59    64   337.000  1.449
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    69   268.000  1.529
   69    70   340.000  1.090
   69    72   317.000  1.522
   69    74   305.000  1.457
   72    73   570.000  1.229
   72    79   490.000  1.335
   79    80   434.000  1.010
   79    87   337.000  1.449
   87    88   340.000  1.090
   87    89   317.000  1.522
   87    91   268.000  1.529
   89    90   570.000  1.229
   89    94   490.000  1.335
   94    95   434.000  1.010
   94   100   337.000  1.449
  100   101   340.000  1.090
  100   102   317.000  1.522
  100   104   268.000  1.529
  102   103   570.000  1.229
  102    44   490.000  1.335
   44    45   434.000  1.010
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   382.000  1.448
  107   108   434.000  1.010
  107   109   382.000  1.448
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
   91    92   340.000  1.090
   91    93   340.000  1.090
   91    96   268.000  1.529
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   340.000  1.090
   74    75   434.000  1.010
   74    76   434.000  1.010
   57    58   340.000  1.090
   57    61   268.000  1.529
   57    81   382.000  1.448
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    67   270.000  1.508
   67    68   370.000  1.093
   67    71   500.000  1.261
   71    77   315.000  1.435
   77    78   340.000  1.090
   77    81   382.000  1.448
   77    83   367.000  1.471
   81    82   434.000  1.010
   83    84   434.000  1.010
   83    85   434.000  1.010
   83    86   434.000  1.010
   40    41   434.000  1.010
   40    46   490.000  1.335
   46    47   570.000  1.229
   46    50   490.000  1.335
   50    51   434.000  1.010
   50    52   434.000  1.010
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  108.68000
   29    33    40    80.00000  108.62000
   33    38    39    37.50000  110.70000
   33    38    42    63.00000  111.10000
   33    38    44    80.00000  109.70000
   33    40    41    38.00000  118.40000
   33    40    46    50.00000  121.90000
   38    33    34    37.50000  110.70000
   38    42    43    80.00000  120.40000
   38    42    48    70.00000  116.60000
   38    44   102    50.00000  121.90000
   38    44    45    38.00000  118.40000
   42    38    39    35.00000  109.50000
   42    48    49    35.00000  119.80000
   42    48    53    50.00000  121.90000
   48    42    43    80.00000  122.90000
   48    53    54    35.00000  109.50000
   48    53    55    63.00000  110.10000
   48    53    57    80.00000  109.70000
   53    48    49    38.00000  118.40000
   53    55    56    80.00000  120.40000
   53    55    59    70.00000  116.60000
   53    57    58    37.50000  110.70000
   53    57    61    58.35000  112.70000
   53    57    81    56.20000  109.47000
   55    53    54    35.00000  109.50000
   55    59    60    35.00000  119.80000
   55    59    64    50.00000  121.90000
   59    55    56    80.00000  122.90000
   59    64    65    35.00000  109.50000
   59    64    66    35.00000  109.50000
   59    64    69    70.00000  110.72300
   64    59    60    38.00000  118.40000
   64    69    70    37.50000  110.70000
   64    69    72    63.00000  111.10000
   64    69    74    80.00000  111.22000
   66    64    65    33.00000  107.80000
   69    64    65    37.50000  110.70000
   69    64    66    37.50000  110.70000
   69    72    73    80.00000  120.40000
   69    72    79    70.00000  116.60000
   69    74    75    50.00000  111.55300
   69    74    76    50.00000  111.55300
   72    69    70    35.00000  109.50000
   72    79    80    35.00000  119.80000
   72    79    87    50.00000  121.90000
   79    72    73    80.00000  122.90000
   79    87    88    35.00000  109.50000
   79    87    89    63.00000  110.10000
   79    87    91    80.00000  109.70000
   87    79    80    38.00000  118.40000
   87    89    90    80.00000  120.40000
   87    89    94    70.00000  116.60000
   87    91    92    37.50000  110.70000
   87    91    93    37.50000  110.70000
   87    91    96    58.35000  112.70000
   89    87    88    35.00000  109.50000
   89    94    95    35.00000  119.80000
   89    94   100    50.00000  121.90000
   94    89    90    80.00000  122.90000
   94   100   101    35.00000  109.50000
   94   100   102    63.00000  110.10000
   94   100   104    80.00000  109.70000
  100    94    95    38.00000  118.40000
  100   102   103    80.00000  120.40000
  100   102    44    70.00000  116.60000
  100   104   105    37.50000  110.70000
  100   104   106    37.50000  110.70000
  100   104   107    56.20000  109.47000
  102   100   101    35.00000  109.50000
  102    44    45    35.00000  119.80000
   44    38    39    35.00000  109.50000
   44    38    42    63.00000  110.10000
   44   102   103    80.00000  122.90000
  104   100   101    37.50000  110.70000
  104   100   102    63.00000  111.10000
  104   107   108    35.00000  109.50000
  104   107   109    51.80000  107.20000
  106   104   105    33.00000  107.80000
  107   104   105    35.00000  109.50000
  107   104   106    35.00000  109.50000
  107   109   110    35.00000  109.50000
  107   109   111    35.00000  109.50000
  107   109   112    35.00000  109.50000
  109   107   108    35.00000  109.50000
  111   109   110    33.00000  107.80000
  112   109   110    33.00000  107.80000
  112   109   111    33.00000  107.80000
   91    87    88    37.50000  110.70000
   91    87    89    63.00000  111.10000
   91    96    97    37.50000  110.70000
   91    96    98    37.50000  110.70000
   91    96    99    37.50000  110.70000
   93    91    92    33.00000  107.80000
   96    91    92    37.50000  110.70000
   96    91    93    37.50000  110.70000
   98    96    97    33.00000  107.80000
   99    96    97    33.00000  107.80000
   99    96    98    33.00000  107.80000
   74    69    70    50.00000  109.55000
   74    69    72    75.00000  111.54000
   76    74    75    43.60000  106.40000
   57    53    54    37.50000  110.70000
   57    53    55    63.00000  111.10000
   57    61    62    37.50000  110.70000
   57    61    63    37.50000  110.70000
   57    61    67    70.00000  111.76100
   57    81    77    51.80000  107.20000
   57    81    82    35.00000  109.50000
   61    57    58    37.50000  110.70000
   61    67    68    40.00000  113.58700
   61    67    71    65.00000  122.10100
   63    61    62    33.00000  107.80000
   67    61    62    45.00000  109.49600
   67    61    63    45.00000  109.49600
   67    71    77    70.00000  113.48600
   71    67    68    45.00000  120.55300
   71    77    78    50.00000  110.29200
   71    77    81    85.00000  109.00000
   71    77    83    85.00000  109.00000
   77    81    82    35.00000  109.50000
   77    83    84    35.00000  109.50000
   77    83    85    35.00000  109.50000
   77    83    86    35.00000  109.50000
   81    57    58    35.00000  109.50000
   81    57    61    56.20000  109.47000
   81    77    78    35.00000  109.50000
   83    77    78    35.00000  109.50000
   83    77    81    85.00000  109.00000
   85    83    84    35.00000  109.50000
   86    83    84    35.00000  109.50000
   86    83    85    35.00000  109.50000
   40    33    34    35.00000  109.50000
   40    33    38    70.00000  110.72300
   40    46    47    80.00000  122.90000
   40    46    50    90.00000  111.91700
   46    40    41    35.00000  119.80000
   46    50    51    35.00000  119.80000
   46    50    52    35.00000  119.80000
   50    46    47    80.00000  122.90000
   52    50    51    35.00000  120.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
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   40    46    50    51   2.56700 -1.0 2.0
   40    46    50    52   2.56700 -1.0 2.0
   41    40    46    47   2.45000 -1.0 2.0
   41    40    46    50   2.56700 -1.0 2.0
   47    46    50    51   2.45000 -1.0 2.0
   47    46    50    52   2.45000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   38    48    42    43  10.50000 -1.0 2.0
   49    42    48    53   1.00000 -1.0 2.0
   53    59    55    56  10.50000 -1.0 2.0
   60    55    59    64   1.00000 -1.0 2.0
   69    79    72    73  10.50000 -1.0 2.0
   80    72    79    87   1.00000 -1.0 2.0
   87    94    89    90  10.50000 -1.0 2.0
   95    89    94   100   1.00000 -1.0 2.0
  100    44   102   103  10.50000 -1.0 2.0
   45   102    44    38   1.00000 -1.0 2.0
   61    68    67    71  10.50000 -1.0 2.0
   41    46    40    33   1.00000 -1.0 2.0
   40    50    46    47  10.50000 -1.0 2.0
   52    46    50    51   1.00000 -1.0 2.0
END
