* LIGAND DATABASE FILE (OPLS2005)
*
001     121   122    228    343     678
    1     0 S   NP   _N1_     1    29.52207    92.15587   -25.50299
    2     1 S   H    _HN1     2     1.02935   100.95784     4.39329
    3     1 S   H    _H1_     3     1.02845     6.53753   168.70537
    4     1 S   H    _H2_     4     1.02801   108.80228  -109.33576
    5     1 S   CT   _CA1     5     1.50070   115.47011   123.71333
    6     5 S   HC   _HA1     6     1.09584   105.25080    64.67745
    7     5 S   CO3  _C1_     7     1.53825   112.06390   -55.45430
    8     7 S   O2Z  _O11     8     1.26410   115.14141   -55.65851
    9     7 S   O2Z  _O12     9     1.26211   114.89471   123.46320
   10     5 S   CT   _CB1    10     1.53057   107.39028  -177.65707
   11    10 S   HC   HB11    11     1.09833   109.52942   -51.09596
   12    10 S   HC   HB12    12     1.09753   110.45407    65.42757
   13    10 S   CT   _CG1    13     1.52968   112.47199  -172.01466
   14    13 S   HC   HG11    14     1.09597   110.64448   -61.35119
   15    13 S   HC   HG12    15     1.09650   109.84645    57.90244
   16    13 S   C    _CD1    16     1.51723   112.08339   178.58018
   17    16 S   O    _OE1    17     1.22747   123.21841     5.94785
   18    16 S   N    _N2_    18     1.38676   111.77973  -174.56541
   19    18 S   H    _HN2    19     1.01573   119.13497     2.96187
   20    18 S   CT1  _CA2    20     1.46040   123.13559  -179.00870
   21    20 S   HC   _HA2    21     1.09549   109.10779     1.97883
   22    20 S   C    _C2_    22     1.53497   109.41057  -113.10888
   23    22 S   O    _O2_    23     1.23081   122.06434  -151.18224
   24    20 S   CT   _CB2    32     1.53505   111.87144   124.05601
   25    24 S   HC   HB21    33     1.09674   109.34752    68.64692
   26    24 S   HC   HB22    34     1.09512   110.76303  -174.57119
   27    22 S   N    _N3_    24     1.38267   113.84668    36.33423
   28    27 S   H    _HN3    25     1.01593   119.56080    -3.57626
   29    24 S   S    _SG2    35     1.83048   115.02761   -50.39730
   30    27 S   CT   _CA3    26     1.45282   123.19036   176.92846
   31    30 S   HC   HA31    27     1.09552   107.53493   -63.73039
   32    30 S   HC   HA32    28     1.09557   107.94949    52.69117
   33    29 S   CT   _C10    36     1.84182   101.04594   -66.12268
   34    33 S   HC   _H5_    37     1.09321   108.69115    38.01662
   35    30 S   CO3  _C3_    29     1.52950   114.10372   174.66785
   36    35 S   O2Z  _O31    30     1.26370   116.07063    -0.79031
   37    35 S   O2Z  _O32    31     1.26426   114.41114   179.27153
   38    33 S   CM   _C9_    38     1.51145   106.54623   155.74293
   39    38 S   HC   _H20    39     1.08817   117.57663    62.73734
   40    33 S   CT   _C11    66     1.53365   109.62364   -82.58956
   41    40 S   HC   _H21    67     1.09594   110.85093    51.30383
   42    40 S   HC   _H22    68     1.09501   110.07062   -68.12477
   43    38 S   CM   _C8_    40     1.34334   123.30483  -114.75312
   44    43 S   HC   _H19    41     1.08851   119.06976    -2.12670
   45    43 S   CT   _C7_    42     1.51981   124.36728   174.91177
   46    45 S   HC   _H4_    43     1.09901   108.18389     1.07046
   47    45 S   CT   _C6_    44     1.55130   109.74975   119.67084
   48    47 S   HC   _H3_    45     1.09795   109.83751    50.10172
   49    45 S   CT   _C32   117     1.53772   108.43915  -116.18247
   50    49 S   HC   _H49   118     1.09552   111.44753   -59.54486
   51    49 S   HC   _H50   119     1.09318   111.21345   179.00044
   52    47 S   OS   _O35    46     1.45160   107.41068   -70.77495
   53    47 S   CT   _C5_   110     1.53869   113.66872   171.51288
   54    53 S   HC   _H17   111     1.09476   110.27871   -63.58467
   55    53 S   HC   _H18   112     1.09662   109.82444    55.14103
   56    49 S   OH   _O39   120     1.42503   110.13203    61.21575
   57    56 S   HO   _H51   121     0.97592   106.81135  -178.54330
   58    52 S   CO4  _C20    47     1.35775   118.35069   115.61545
   59    58 S   O    _O34    48     1.21966   127.48951    -2.27512
   60    53 S   CT   _C4_   113     1.52483   112.75671   175.93962
   61    60 S   HC   _H14   114     1.09422   111.55589   -64.65016
   62    60 S   HC   _H15   115     1.09475   110.03816   175.95828
   63    60 S   HC   _H16   116     1.09459   110.95027    56.41309
   64    58 S   CM   _C19    49     1.47846   107.16598   177.29904
   65    64 S   HC   _H26    50     1.08438   118.37389   -12.22573
   66    64 S   CM   _C18    51     1.34027   120.02555   166.59574
   67    66 S   HC   _H25    52     1.08851   119.87570     0.44367
   68    66 S   CT   _C17    53     1.51021   123.56053   179.90513
   69    68 S   HC   _H9_    54     1.09685   110.16428    -1.62654
   70    68 S   CT   _C16    55     1.55712   113.01047   120.50587
   71    70 S   HC   _H8_    56     1.09648   108.25448    52.79581
   72    68 S   CT   _C21   106     1.53838   107.36204  -116.36950
   73    72 S   HC   _H27   107     1.09595   111.41077   -68.00496
   74    72 S   HC   _H28   108     1.09480   111.24454   171.34740
   75    72 S   HC   _H29   109     1.09634   111.10546    52.32673
   76    70 S   CT   _C15    57     1.55981   116.55326   -70.79218
   77    76 S   HC   _H7_    58     1.09813   106.63386  -172.07070
   78    70 S   OS   _O36    77     1.44399   107.42704   170.03019
   79    76 S   CT   _C14    59     1.54321   116.76722    68.68060
   80    79 S   HC   _H23    60     1.09384   110.03975   -70.02889
   81    79 S   HC   _H24    61     1.09891   107.54462   176.90238
   82    76 S   CT   _C30    73     1.53860   112.01486   -57.75056
   83    82 S   HC   _H43    74     1.09447   111.67502    70.28988
   84    82 S   HC   _H44    75     1.09444   111.59034   -51.14891
   85    82 S   HC   _H45    76     1.09581   110.39967  -170.30525
   86    78 S   CO   _C22    78     1.43441   113.88744  -126.81918
   87    86 S   HC   _H10    79     1.09824   108.14054    55.73671
   88    79 S   CT   _C13    62     1.53598   115.77822    55.47801
   89    88 S   HC   _H6_    63     1.09495   109.84903   -47.56746
   90    86 S   CT   _C23    80     1.53780   107.06213   174.42258
   91    90 S   HC   _H11    81     1.09514   108.67528    53.21359
   92    88 S   CO4  _C12    64     1.52846   110.48492  -162.95642
   93    92 S   O    _O33    65     1.23277   119.90078   116.58156
   94    88 S   CT   _C31    69     1.52474   112.75486    72.44069
   95    94 S   HC   _H46    70     1.09518   111.64203    55.13544
   96    94 S   HC   _H47    71     1.09387   110.96307   -65.30104
   97    94 S   HC   _H48    72     1.09546   110.80945   174.91046
   98    90 S   CT   _C24    82     1.53493   110.33476   175.08295
   99    98 S   HC   _H12    83     1.09840   107.84910    68.99457
  100    90 S   OH   _O38   104     1.42859   110.59612   -64.00523
  101   100 S   HO   _H42   105     0.97273   108.45275   -48.51326
  102    98 S   CT   _C25    84     1.52727   111.33421   -51.14196
  103   102 S   HC   _H30    85     1.09525   110.99617   174.56963
  104   102 S   HC   _H31    86     1.09652   109.96656   -66.17881
  105    98 S   NP   _N4_    94     1.52703   110.20877  -177.01863
  106   105 S   H    _H35    95     1.03040   104.83082   -42.58393
  107   102 S   CT   _C26    87     1.53103   109.24399    52.86578
  108   107 S   HC   _H13    88     1.09736   110.56184    62.37169
  109   105 S   CT   _C28    96     1.50609   116.39069    73.56235
  110   109 S   HC   _H36    97     1.09269   108.99332    70.93334
  111   109 S   HC   _H37    98     1.09370   107.66997  -169.47527
  112   109 S   HC   _H38    99     1.09097   109.07997   -50.84768
  113   105 S   CT   _C29   100     1.50760   112.64758  -156.68022
  114   113 S   HC   _H39   101     1.09252   108.82410   -67.29543
  115   113 S   HC   _H40   102     1.09303   108.26813    53.70277
  116   113 S   HC   _H41   103     1.09340   107.98964   172.34670
  117    86 S   OS   _O37    89     1.42938   111.41814   -65.24266
  118   107 S   CT   _C27    90     1.52236   111.05028  -176.91238
  119   118 S   HC   _H32    91     1.09560   111.08184    62.08079
  120   118 S   HC   _H33    92     1.09417   111.34052   -59.35057
  121   118 S   HC   _H34    93     1.09512   110.32484  -179.87028
  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
  12   7   2   1   1  11   4   9   4   3  11   4  14   8  16   7
   6   3   2   9   7   5   4   1   1   6   3   3   2   1   1   7
   3  11   4  13   8  20   7   5   2   1   1  14   9  10  14   6
   5   4   2   1   1  13   6   7   6  14   7   5   1   3   2   1
   1  20   9   4   1  13   6   5  10   8   6   5   7   3   2   1
   3   2   1   1   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    43    92    40    41    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    43    44    45    88    92    93    40    41    42  
   38    39    43    92    40    41    42  
   36    37  
   37  
    0  
   39    43    44    45    46    47    92    40    41    42    49  
   43    44    45    40  
   41    42    94    43    79    88    89    92    93  
   42    88    92    93  
   88    92    93  
   44    45    46    47    48    52    53    49    50    51    56  
   45    46    47    49  
   46    47    48    52    58    53    54    55    60    49    50    51    56    57  
   47    48    52    53    49    50    51    56  
   48    52    58    59    64    53    54    55    60    61    62    63    49    50    51    56  
   52    58    53    54    55    60    49  
   50    51    56    57    52    53  
   51    56    57  
   56    57  
   58    59    64    65    66    53    54    55    60  
   54    55    60    61    62    63    58  
   55    60    61    62    63  
   60    61    62    63  
   57  
    0  
   59    64    65    66    67    68  
   64    65    66  
   61    62    63  
   62    63  
   63  
    0  
   65    66    67    68    69    70    72  
   66    67    68  
   67    68    69    70    71    76    78    72    73    74    75  
   68    69    70    72  
   69    70    71    76    77    79    82    78    86    72    73    74    75  
   70    71    76    78    72    73    74    75  
   71    76    77    79    80    81    88    82    83    84    85    78    86    87    90   117    72    73    74    75  
   76    77    79    82    78    86    72  
   73    74    75    76    78  
   74    75  
   75  
    0  
   77    79    80    81    88    89    92    94    82    83    84    85    78    86  
   79    80    81    88    82    83    84    85    78  
   86    87    90    91    98   107   117   100    79    82  
   80    81    88    89    92    93    94    95    96    97    82    83    84    85  
   81    88    89    92    94    82  
   88    89    92    94    82  
   83    84    85    88  
   84    85  
   85  
    0  
   87    90    91    98    99   102   107   108   117   118   105   100   101  
   90    91    98   107   117   100  
   89    92    93    94    95    96    97  
   92    93    94    95    96    97  
   91    98    99   102   103   104   107   117   105   106   109   113   100   101  
   98    99   102   117   105   100   101  
   93    94    95    96    97  
   94  
   95    96    97  
   96    97  
   97  
    0  
   99   102   103   104   107   108   117   118   105   106   109   110   111   112   113   114   115   116   100   101  
  102   103   104   107   105   106   109   113   100  
  101   102   105   117  
    0  
  103   104   107   108   117   118   119   120   121   105   106   109   113  
  104   107   108   117   118   105  
  107   108   117   118   105  
  106   109   110   111   112   113   114   115   116   107  
  109   110   111   112   113   114   115   116  
  108   117   118   119   120   121  
  117   118   119   120   121  
  110   111   112   113   114   115   116  
  111   112   113  
  112   113  
  113  
  114   115   116  
  115   116  
  116  
    0  
  118   119   120   121  
  119   120   121  
  120   121  
  121  
    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  -0.115000   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   49   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   57   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   58   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   60   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   67   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   79   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.100000   1.6450   1.4500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   91   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   92   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   93   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   94   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  100   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  101   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  102   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  103   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  104   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  105   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
  106   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
  107   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.5000   0.0300   0.030000   1.6450   1.4500   0.008598240   0.268726247
  109   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
  110   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  112   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  113   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
  114   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  115   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  116   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
  117   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  118   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  119   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  120   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  121   2.5000   0.0300   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   317.000  1.510
   33    40   268.000  1.529
   38    39   340.000  1.080
   38    43   549.000  1.340
   43    44   340.000  1.080
   43    45   317.000  1.510
   45    46   340.000  1.090
   45    47   268.000  1.529
   45    49   268.000  1.529
   47    48   340.000  1.090
   47    52   320.000  1.410
   47    53   268.000  1.529
   52    58   214.000  1.327
   58    59   570.000  1.229
   58    64   320.000  1.462
   64    65   340.000  1.080
   64    66   549.000  1.340
   66    67   340.000  1.080
   66    68   317.000  1.510
   68    69   340.000  1.090
   68    70   268.000  1.529
   68    72   268.000  1.529
   70    71   340.000  1.090
   70    76   268.000  1.529
   70    78   320.000  1.410
   76    77   340.000  1.090
   76    79   268.000  1.529
   76    82   268.000  1.529
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    88   268.000  1.529
   88    89   340.000  1.090
   88    92   317.000  1.522
   88    94   268.000  1.529
   92    93   570.000  1.229
   92    40   317.000  1.522
   40    41   340.000  1.090
   40    42   340.000  1.090
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   78    86   320.000  1.380
   86    87   340.000  1.090
   86    90   250.000  1.527
   86   117   320.000  1.380
   90    91   340.000  1.090
   90    98   268.000  1.529
   90   100   320.000  1.410
   98    99   340.000  1.090
   98   102   268.000  1.529
   98   105   367.000  1.471
  102   103   340.000  1.090
  102   104   340.000  1.090
  102   107   268.000  1.529
  107   108   340.000  1.090
  107   117   320.000  1.410
  107   118   268.000  1.529
  118   119   340.000  1.090
  118   120   340.000  1.090
  118   121   340.000  1.090
  105   106   434.000  1.010
  105   109   367.000  1.471
  105   113   367.000  1.471
  109   110   340.000  1.090
  109   111   340.000  1.090
  109   112   340.000  1.090
  113   114   340.000  1.090
  113   115   340.000  1.090
  113   116   340.000  1.090
  100   101   553.000  0.945
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    60   268.000  1.529
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    63   340.000  1.090
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    56   320.000  1.410
   56    57   553.000  0.945
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    43    70.00000  124.00000
   33    40    92    63.00000  111.10000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    43    44    35.00000  120.00000
   38    43    45    70.00000  124.00000
   43    38    39    35.00000  120.00000
   43    45    46    35.00000  109.50000
   43    45    47    70.00000  112.02700
   43    45    49    70.00000  112.02700
   45    43    44    35.00000  117.00000
   45    47    48    37.50000  110.70000
   45    47    52    50.00000  109.50000
   45    47    53    58.35000  112.70000
   45    49    50    37.50000  110.70000
   45    49    51    37.50000  110.70000
   45    49    56    50.00000  109.50000
   47    45    46    37.50000  110.70000
   47    52    58    83.00000  116.90000
   47    53    54    37.50000  110.70000
   47    53    55    37.50000  110.70000
   47    53    60    58.35000  112.70000
   52    47    48    35.00000  109.50000
   52    58    59    83.00000  123.40000
   52    58    64    90.00000  111.29400
   58    64    65    40.00000  117.72500
   58    64    66    65.00000  118.96000
   64    58    59    80.00000  123.72100
   64    66    67    35.00000  120.00000
   64    66    68    70.00000  124.00000
   66    64    65    35.00000  120.00000
   66    68    69    35.00000  109.50000
   66    68    70    70.00000  112.02700
   66    68    72    70.00000  112.02700
   68    66    67    35.00000  117.00000
   68    70    71    37.50000  110.70000
   68    70    76    58.35000  112.70000
   68    70    78    50.00000  109.50000
   68    72    73    37.50000  110.70000
   68    72    74    37.50000  110.70000
   68    72    75    37.50000  110.70000
   70    68    69    37.50000  110.70000
   70    76    77    37.50000  110.70000
   70    76    79    58.35000  112.70000
   70    76    82    58.35000  112.70000
   70    78    86    60.00000  109.50000
   76    70    71    37.50000  110.70000
   76    79    80    37.50000  110.70000
   76    79    81    37.50000  110.70000
   76    79    88    58.35000  112.70000
   76    82    83    37.50000  110.70000
   76    82    84    37.50000  110.70000
   76    82    85    37.50000  110.70000
   79    76    77    37.50000  110.70000
   79    88    89    37.50000  110.70000
   79    88    92    63.00000  111.10000
   79    88    94    58.35000  112.70000
   81    79    80    33.00000  107.80000
   88    79    80    37.50000  110.70000
   88    79    81    37.50000  110.70000
   88    92    93    80.00000  120.40000
   88    92    40    70.00000  116.00000
   88    94    95    37.50000  110.70000
   88    94    96    37.50000  110.70000
   88    94    97    37.50000  110.70000
   92    88    89    35.00000  109.50000
   92    40    41    35.00000  109.50000
   92    40    42    35.00000  109.50000
   40    33    34    37.50000  110.70000
   40    33    38    70.00000  112.02700
   40    92    93    80.00000  120.40000
   42    40    41    33.00000  107.80000
   94    88    89    37.50000  110.70000
   94    88    92    63.00000  111.10000
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   82    76    77    37.50000  110.70000
   82    76    79    58.35000  112.70000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   78    70    71    35.00000  109.50000
   78    70    76    50.00000  109.50000
   78    86    87    35.00000  109.50000
   78    86    90    90.00000  108.56700
   78    86   117    92.60000  111.55000
   86    90    91    45.00000  108.72000
   86    90    98    75.00000  109.43000
   86    90   100    90.00000  111.58700
   86   117   107    60.00000  109.50000
   90    86    87    45.00000  112.01100
   90    98    99    37.50000  110.70000
   90    98   102    58.35000  112.70000
   90    98   105    80.00000  111.20000
   90   100   101    55.00000  108.50000
   98    90    91    37.50000  110.70000
   98   102   103    37.50000  110.70000
   98   102   104    37.50000  110.70000
   98   102   107    58.35000  112.70000
   98   105   106    35.00000  109.50000
   98   105   109    75.00000  113.01200
   98   105   113    75.00000  113.01200
  102    98    99    37.50000  110.70000
  102   107   108    37.50000  110.70000
  102   107   117    50.00000  109.50000
  102   107   118    58.35000  112.70000
  104   102   103    33.00000  107.80000
  107   102   103    37.50000  110.70000
  107   102   104    37.50000  110.70000
  107   118   119    37.50000  110.70000
  107   118   120    37.50000  110.70000
  107   118   121    37.50000  110.70000
  117    86    87    35.00000  109.50000
  117    86    90    90.00000  108.56700
  117   107   108    35.00000  109.50000
  118   107   108    37.50000  110.70000
  118   107   117    50.00000  109.50000
  120   118   119    33.00000  107.80000
  121   118   119    33.00000  107.80000
  121   118   120    33.00000  107.80000
  105    98    99    35.00000  109.50000
  105    98   102    80.00000  111.20000
  105   109   110    35.00000  109.50000
  105   109   111    35.00000  109.50000
  105   109   112    35.00000  109.50000
  105   113   114    35.00000  109.50000
  105   113   115    35.00000  109.50000
  105   113   116    35.00000  109.50000
  109   105   106    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
  113   105   106    35.00000  109.50000
  113   105   109    75.00000  113.01200
  115   113   114    33.00000  107.80000
  116   113   114    33.00000  107.80000
  116   113   115    33.00000  107.80000
  100    90    91    35.00000  109.50000
  100    90    98    50.00000  109.50000
   72    68    69    37.50000  110.70000
   72    68    70    58.35000  112.70000
   74    72    73    33.00000  107.80000
   75    72    73    33.00000  107.80000
   75    72    74    33.00000  107.80000
   53    47    48    37.50000  110.70000
   53    47    52    50.00000  109.50000
   53    60    61    37.50000  110.70000
   53    60    62    37.50000  110.70000
   53    60    63    37.50000  110.70000
   55    53    54    33.00000  107.80000
   60    53    54    37.50000  110.70000
   60    53    55    37.50000  110.70000
   62    60    61    33.00000  107.80000
   63    60    61    33.00000  107.80000
   63    60    62    33.00000  107.80000
   49    45    46    37.50000  110.70000
   49    45    47    58.35000  112.70000
   49    56    57    55.00000  108.50000
   51    49    50    33.00000  107.80000
   56    49    50    35.00000  109.50000
   56    49    51    35.00000  109.50000
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    43   0.42700  1.0 1.0
   29    33    38    43  -0.70350 -1.0 2.0
   29    33    38    43  -0.43150  1.0 3.0
   29    33    40    92   0.56750  1.0 1.0
   29    33    40    92  -0.07550 -1.0 2.0
   29    33    40    92   0.20000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   33    38    43    44   7.00000 -1.0 2.0
   33    38    43    45   7.00000 -1.0 2.0
   34    33    38    39   0.33100  1.0 3.0
   34    33    38    43   0.00000  1.0 1.0
   34    33    40    92  -0.11250  1.0 3.0
   34    33    40    41   0.15000  1.0 3.0
   34    33    40    42   0.15000  1.0 3.0
   38    33    40    92  -0.98800  1.0 1.0
   38    33    40    92   0.48800 -1.0 2.0
   38    33    40    92   0.76800  1.0 3.0
   38    33    40    41   0.15000  1.0 3.0
   38    33    40    42   0.15000  1.0 3.0
   38    43    45    46   0.00000  1.0 1.0
   38    43    45    47   0.09850  1.0 1.0
   38    43    45    47   0.15250 -1.0 2.0
   38    43    45    47  -0.50650  1.0 3.0
   38    43    45    49   0.09850  1.0 1.0
   38    43    45    49   0.15250 -1.0 2.0
   38    43    45    49  -0.50650  1.0 3.0
   39    38    43    44   7.00000 -1.0 2.0
   39    38    43    45   7.00000 -1.0 2.0
   43    45    47    48   0.15000  1.0 3.0
   43    45    47    52   0.61850  1.0 1.0
   43    45    47    52  -0.22750 -1.0 2.0
   43    45    47    52   0.15300  1.0 3.0
   43    45    47    53   0.34400  1.0 1.0
   43    45    47    53   0.09450 -1.0 2.0
   43    45    47    53   0.11100  1.0 3.0
   43    45    49    50   0.15000  1.0 3.0
   43    45    49    51   0.15000  1.0 3.0
   43    45    49    56   1.05650  1.0 1.0
   43    45    49    56   0.15600 -1.0 2.0
   43    45    49    56   0.53150  1.0 3.0
   44    43    45    46   0.33100  1.0 3.0
   44    43    45    47   0.00000  1.0 1.0
   44    43    45    49   0.00000  1.0 1.0
   45    47    52    58  -0.25900  1.0 1.0
   45    47    52    58  -0.47000 -1.0 2.0
   45    47    52    58   0.11750  1.0 3.0
   45    47    53    54   0.15000  1.0 3.0
   45    47    53    55   0.15000  1.0 3.0
   45    47    53    60   0.56750  1.0 1.0
   45    47    53    60  -0.07550 -1.0 2.0
   45    47    53    60   0.20000  1.0 3.0
   45    49    56    57  -0.11600  1.0 1.0
   45    49    56    57  -0.09450 -1.0 2.0
   45    49    56    57   0.21250  1.0 3.0
   46    45    47    48   0.15000  1.0 3.0
   46    45    47    52   0.23400  1.0 3.0
   46    45    47    53   0.15000  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    51   0.15000  1.0 3.0
   46    45    49    56   0.23400  1.0 3.0
   47    45    49    50   0.15000  1.0 3.0
   47    45    49    51   0.15000  1.0 3.0
   47    45    49    56   0.86500  1.0 1.0
   47    45    49    56  -0.17500 -1.0 2.0
   47    45    49    56   0.20800  1.0 3.0
   47    52    58    59   3.00000 -1.0 2.0
   47    52    58    64   2.00000 -1.0 2.0
   47    53    60    61   0.15000  1.0 3.0
   47    53    60    62   0.15000  1.0 3.0
   47    53    60    63   0.15000  1.0 3.0
   48    47    52    58   0.08050  1.0 3.0
   48    47    53    54   0.15000  1.0 3.0
   48    47    53    55   0.15000  1.0 3.0
   48    47    53    60   0.15000  1.0 3.0
   52    47    53    54   0.23400  1.0 3.0
   52    47    53    55   0.23400  1.0 3.0
   52    47    53    60   0.62750  1.0 1.0
   52    47    53    60  -0.30950 -1.0 2.0
   52    47    53    60   0.27300  1.0 3.0
   52    58    64    65   1.63100 -1.0 2.0
   52    58    64    66  -0.56150  1.0 1.0
   52    58    64    66   2.19150 -1.0 2.0
   58    64    66    67   7.00000 -1.0 2.0
   58    64    66    68   7.00000 -1.0 2.0
   59    58    64    65   0.00000  1.0 1.0
   59    58    64    66   1.00000 -1.0 2.0
   64    66    68    69   0.00000  1.0 1.0
   64    66    68    70   0.09850  1.0 1.0
   64    66    68    70   0.15250 -1.0 2.0
   64    66    68    70  -0.50650  1.0 3.0
   64    66    68    72   0.09850  1.0 1.0
   64    66    68    72   0.15250 -1.0 2.0
   64    66    68    72  -0.50650  1.0 3.0
   65    64    66    67   7.00000 -1.0 2.0
   65    64    66    68   7.00000 -1.0 2.0
   66    68    70    71   0.15000  1.0 3.0
   66    68    70    76   0.34400  1.0 1.0
   66    68    70    76   0.09450 -1.0 2.0
   66    68    70    76   0.11100  1.0 3.0
   66    68    70    78   0.61850  1.0 1.0
   66    68    70    78  -0.22750 -1.0 2.0
   66    68    70    78   0.15300  1.0 3.0
   66    68    72    73   0.15000  1.0 3.0
   66    68    72    74   0.15000  1.0 3.0
   66    68    72    75   0.15000  1.0 3.0
   67    66    68    69   0.33100  1.0 3.0
   67    66    68    70   0.00000  1.0 1.0
   67    66    68    72   0.00000  1.0 1.0
   68    70    76    77   0.15000  1.0 3.0
   68    70    76    79   0.56750  1.0 1.0
   68    70    76    79  -0.07550 -1.0 2.0
   68    70    76    79   0.20000  1.0 3.0
   68    70    76    82   0.56750  1.0 1.0
   68    70    76    82  -0.07550 -1.0 2.0
   68    70    76    82   0.20000  1.0 3.0
   68    70    78    86   0.06250  1.0 1.0
   68    70    78    86  -0.01100 -1.0 2.0
   68    70    78    86   0.28050  1.0 3.0
   69    68    70    71   0.15000  1.0 3.0
   69    68    70    76   0.15000  1.0 3.0
   69    68    70    78   0.23400  1.0 3.0
   69    68    72    73   0.15000  1.0 3.0
   69    68    72    74   0.15000  1.0 3.0
   69    68    72    75   0.15000  1.0 3.0
   70    68    72    73   0.15000  1.0 3.0
   70    68    72    74   0.15000  1.0 3.0
   70    68    72    75   0.15000  1.0 3.0
   70    76    79    80   0.15000  1.0 3.0
   70    76    79    81   0.15000  1.0 3.0
   70    76    79    88   0.56750  1.0 1.0
   70    76    79    88  -0.07550 -1.0 2.0
   70    76    79    88   0.20000  1.0 3.0
   70    76    82    83   0.15000  1.0 3.0
   70    76    82    84   0.15000  1.0 3.0
   70    76    82    85   0.15000  1.0 3.0
   70    78    86    87   0.37050  1.0 3.0
   70    78    86    90   0.06250  1.0 1.0
   70    78    86    90  -0.01100 -1.0 2.0
   70    78    86    90   0.28050  1.0 3.0
   70    78    86   117  -0.53350  1.0 1.0
   70    78    86   117  -0.78350 -1.0 2.0
   70    78    86   117   0.33750  1.0 3.0
   71    70    76    77   0.15000  1.0 3.0
   71    70    76    79   0.15000  1.0 3.0
   71    70    76    82   0.15000  1.0 3.0
   71    70    78    86   0.37050  1.0 3.0
   76    70    78    86   0.06250  1.0 1.0
   76    70    78    86  -0.01100 -1.0 2.0
   76    70    78    86   0.28050  1.0 3.0
   76    79    88    89   0.15000  1.0 3.0
   76    79    88    92  -0.95700  1.0 1.0
   76    79    88    92  -0.18200 -1.0 2.0
   76    79    88    92   0.29450  1.0 3.0
   76    79    88    94   0.56750  1.0 1.0
   76    79    88    94  -0.07550 -1.0 2.0
   76    79    88    94   0.20000  1.0 3.0
   77    76    79    80   0.15000  1.0 3.0
   77    76    79    81   0.15000  1.0 3.0
   77    76    79    88   0.15000  1.0 3.0
   77    76    82    83   0.15000  1.0 3.0
   77    76    82    84   0.15000  1.0 3.0
   77    76    82    85   0.15000  1.0 3.0
   79    76    82    83   0.15000  1.0 3.0
   79    76    82    84   0.15000  1.0 3.0
   79    76    82    85   0.15000  1.0 3.0
   79    88    92    93   0.30150 -1.0 2.0
   79    88    92    40   0.60050  1.0 1.0
   79    88    92    40   0.05600 -1.0 2.0
   79    88    92    40   0.26150  1.0 3.0
   79    88    94    95   0.15000  1.0 3.0
   79    88    94    96   0.15000  1.0 3.0
   79    88    94    97   0.15000  1.0 3.0
   80    79    88    89   0.15000  1.0 3.0
   80    79    88    92  -0.11250  1.0 3.0
   80    79    88    94   0.15000  1.0 3.0
   81    79    88    89   0.15000  1.0 3.0
   81    79    88    92  -0.11250  1.0 3.0
   81    79    88    94   0.15000  1.0 3.0
   88    92    40    33   0.60050  1.0 1.0
   88    92    40    33   0.05600 -1.0 2.0
   88    92    40    33   0.26150  1.0 3.0
   88    92    40    41   0.00000  1.0 1.0
   88    92    40    42   0.00000  1.0 1.0
   89    88    92    93   0.00000  1.0 1.0
   89    88    92    40   0.00000  1.0 1.0
   89    88    94    95   0.15000  1.0 3.0
   89    88    94    96   0.15000  1.0 3.0
   89    88    94    97   0.15000  1.0 3.0
   92    88    94    95  -0.11250  1.0 3.0
   92    88    94    96  -0.11250  1.0 3.0
   92    88    94    97  -0.11250  1.0 3.0
   93    92    40    33   0.30150 -1.0 2.0
   93    92    40    41   0.00000  1.0 1.0
   93    92    40    42   0.00000  1.0 1.0
   40    33    38    39   0.00000  1.0 1.0
   40    33    38    43   0.09850  1.0 1.0
   40    33    38    43   0.15250 -1.0 2.0
   40    33    38    43  -0.50650  1.0 3.0
   94    88    92    93   0.30150 -1.0 2.0
   94    88    92    40   0.60050  1.0 1.0
   94    88    92    40   0.05600 -1.0 2.0
   94    88    92    40   0.26150  1.0 3.0
   82    76    79    80   0.15000  1.0 3.0
   82    76    79    81   0.15000  1.0 3.0
   82    76    79    88   0.56750  1.0 1.0
   82    76    79    88  -0.07550 -1.0 2.0
   82    76    79    88   0.20000  1.0 3.0
   78    70    76    77   0.23400  1.0 3.0
   78    70    76    79   0.62750  1.0 1.0
   78    70    76    79  -0.30950 -1.0 2.0
   78    70    76    79   0.27300  1.0 3.0
   78    70    76    82   0.62750  1.0 1.0
   78    70    76    82  -0.30950 -1.0 2.0
   78    70    76    82   0.27300  1.0 3.0
   78    86    90    91   0.23400  1.0 3.0
   78    86    90    98   0.62750  1.0 1.0
   78    86    90    98  -0.30950 -1.0 2.0
   78    86    90    98   0.27300  1.0 3.0
   78    86    90   100   3.69350  1.0 1.0
   78    86    90   100  -1.82950 -1.0 2.0
   78    86   117   107  -0.81800  1.0 1.0
   86    90    98    99   0.15000  1.0 3.0
   86    90    98   102   3.97050  1.0 1.0
   86    90    98   105   1.36600  1.0 1.0
   86    90    98   105  -0.11450 -1.0 2.0
   86    90    98   105   0.24250  1.0 3.0
   86    90   100   101  -0.11600  1.0 1.0
   86    90   100   101  -0.09450 -1.0 2.0
   86    90   100   101   0.21250  1.0 3.0
   87    86    90    91   0.15000  1.0 3.0
   87    86    90    98   0.15000  1.0 3.0
   87    86    90   100   0.23400  1.0 3.0
   87    86   117   107   0.37050  1.0 3.0
   90    86   117   107   0.06250  1.0 1.0
   90    86   117   107  -0.01100 -1.0 2.0
   90    86   117   107   0.28050  1.0 3.0
   90    98   102   103   0.15000  1.0 3.0
   90    98   102   104   0.15000  1.0 3.0
   90    98  -102   107   0.56750  1.0 1.0
   90    98  -102   107  -0.07550 -1.0 2.0
   90    98  -102   107   0.20000  1.0 3.0
   90    98   105   106   0.17350  1.0 3.0
   90    98   105   109   0.47100  1.0 1.0
   90    98   105   113   0.47100  1.0 1.0
   91    90    98    99   0.15000  1.0 3.0
   91    90    98   102   0.15000  1.0 3.0
   91    90    98   105   0.19200  1.0 3.0
   91    90   100   101   0.19450  1.0 3.0
   98    90   100   101  -0.11600  1.0 1.0
   98    90   100   101  -0.09450 -1.0 2.0
   98    90   100   101   0.21250  1.0 3.0
   98   102   107   108   0.15000  1.0 3.0
   98   102   107   117   0.62750  1.0 1.0
   98   102   107   117  -0.30950 -1.0 2.0
   98   102   107   117   0.27300  1.0 3.0
   98   102   107   118   0.56750  1.0 1.0
   98   102   107   118  -0.07550 -1.0 2.0
   98   102   107   118   0.20000  1.0 3.0
   98   105   109   110   0.15000  1.0 3.0
   98   105   109   111   0.15000  1.0 3.0
   98   105   109   112   0.15000  1.0 3.0
   98   105   113   114   0.15000  1.0 3.0
   98   105   113   115   0.15000  1.0 3.0
   98   105   113   116   0.15000  1.0 3.0
   99    98   102   103   0.15000  1.0 3.0
   99    98   102   104   0.15000  1.0 3.0
   99    98   102   107   0.15000  1.0 3.0
   99    98   105   106   0.13050  1.0 3.0
   99    98   105   109   0.15000  1.0 3.0
   99    98   105   113   0.15000  1.0 3.0
  102    98   105   106   0.17350  1.0 3.0
  102    98   105   109   0.47100  1.0 1.0
  102    98   105   113   0.47100  1.0 1.0
  102   107  -117    86   0.06250  1.0 1.0
  102   107  -117    86  -0.01100 -1.0 2.0
  102   107  -117    86   0.28050  1.0 3.0
  102   107   118   119   0.15000  1.0 3.0
  102   107   118   120   0.15000  1.0 3.0
  102   107   118   121   0.15000  1.0 3.0
  103   102   107   108   0.15000  1.0 3.0
  103   102   107   117   0.23400  1.0 3.0
  103   102   107   118   0.15000  1.0 3.0
  104   102   107   108   0.15000  1.0 3.0
  104   102   107   117   0.23400  1.0 3.0
  104   102   107   118   0.15000  1.0 3.0
  108   107   117    86   0.37050  1.0 3.0
  108   107   118   119   0.15000  1.0 3.0
  108   107   118   120   0.15000  1.0 3.0
  108   107   118   121   0.15000  1.0 3.0
  117    86    90    91   0.23400  1.0 3.0
  117    86   -90    98   0.62750  1.0 1.0
  117    86   -90    98  -0.30950 -1.0 2.0
  117    86   -90    98   0.27300  1.0 3.0
  117    86    90   100   3.69350  1.0 1.0
  117    86    90   100  -1.82950 -1.0 2.0
  117   107   118   119   0.23400  1.0 3.0
  117   107   118   120   0.23400  1.0 3.0
  117   107   118   121   0.23400  1.0 3.0
  118   107   117    86   0.06250  1.0 1.0
  118   107   117    86  -0.01100 -1.0 2.0
  118   107   117    86   0.28050  1.0 3.0
  105    98   102   103   0.19200  1.0 3.0
  105    98   102   104   0.19200  1.0 3.0
  105    98   102   107   1.36600  1.0 1.0
  105    98   102   107  -0.11450 -1.0 2.0
  105    98   102   107   0.24250  1.0 3.0
  106   105   109   110   0.13050  1.0 3.0
  106   105   109   111   0.13050  1.0 3.0
  106   105   109   112   0.13050  1.0 3.0
  106   105   113   114   0.13050  1.0 3.0
  106   105   113   115   0.13050  1.0 3.0
  106   105   113   116   0.13050  1.0 3.0
  109   105   113   114   0.15000  1.0 3.0
  109   105   113   115   0.15000  1.0 3.0
  109   105   113   116   0.15000  1.0 3.0
  113   105   109   110   0.15000  1.0 3.0
  113   105   109   111   0.15000  1.0 3.0
  113   105   109   112   0.15000  1.0 3.0
  100    90    98    99   0.23400  1.0 3.0
  100    90    98   102   0.86500  1.0 1.0
  100    90    98   102  -0.17500 -1.0 2.0
  100    90    98   102   0.20800  1.0 3.0
  100    90    98   105   1.69300  1.0 1.0
  100    90    98   105  -0.48450 -1.0 2.0
   72    68    70    71   0.15000  1.0 3.0
   72    68    70    76   0.56750  1.0 1.0
   72    68    70    76  -0.07550 -1.0 2.0
   72    68    70    76   0.20000  1.0 3.0
   72    68    70    78   0.62750  1.0 1.0
   72    68    70    78  -0.30950 -1.0 2.0
   72    68    70    78   0.27300  1.0 3.0
   53    47    52    58  -0.25900  1.0 1.0
   53    47    52    58  -0.47000 -1.0 2.0
   53    47    52    58   0.11750  1.0 3.0
   54    53    60    61   0.15000  1.0 3.0
   54    53    60    62   0.15000  1.0 3.0
   54    53    60    63   0.15000  1.0 3.0
   55    53    60    61   0.15000  1.0 3.0
   55    53    60    62   0.15000  1.0 3.0
   55    53    60    63   0.15000  1.0 3.0
   49    45    47    48   0.15000  1.0 3.0
   49    45    47    52   0.62750  1.0 1.0
   49    45    47    52  -0.30950 -1.0 2.0
   49    45    47    52   0.27300  1.0 3.0
   49    45    47    53   0.56750  1.0 1.0
   49    45    47    53  -0.07550 -1.0 2.0
   49    45    47    53   0.20000  1.0 3.0
   50    49    56    57   0.19450  1.0 3.0
   51    49    56    57   0.19450  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    43   1.10000 -1.0 2.0
   45    44    43    38   1.10000 -1.0 2.0
   52    64    58    59  10.50000 -1.0 2.0
   58    65    64    66   1.10000 -1.0 2.0
   68    67    66    64   1.10000 -1.0 2.0
   88    40    92    93  10.50000 -1.0 2.0
END
