* LIGAND DATABASE FILE (OPLS2005)
*
001     117   120    216    331     620
    1     0 S   NP   _N1_     1    29.22837    96.61839   -18.59110
    2     1 S   H    _HN1     2     1.02811    41.32735   163.78431
    3     1 S   H    _H1_     3     1.02749    76.80523   -57.50435
    4     1 S   H    _H2_     4     1.02980    92.53864    50.85025
    5     1 S   CT   _CA1     5     1.50353   149.84444  -169.59149
    6     5 S   HC   _HA1     6     1.09612   104.90567    40.88539
    7     5 S   CO3  _C1_     7     1.53942   112.65358   -77.91440
    8     7 S   O2Z  _O11     8     1.26357   115.07005   -28.34489
    9     7 S   O2Z  _O12     9     1.26299   114.96941   149.86067
   10     5 S   CT   _CB1    10     1.53112   107.05307   158.02176
   11    10 S   HC   HB11    11     1.09810   108.73619   -52.45124
   12    10 S   HC   HB12    12     1.09752   110.32237    63.59134
   13    10 S   CT   _CG1    13     1.52950   113.27948  -173.92888
   14    13 S   HC   HG11    14     1.09582   110.11401   -69.97120
   15    13 S   HC   HG12    15     1.09661   110.14389    49.06055
   16    13 S   C    _CD1    16     1.51966   112.65021   168.76236
   17    16 S   O    _OE1    17     1.22725   123.30925   -13.27562
   18    16 S   N    _N2_    18     1.38609   111.62557   168.57326
   19    18 S   H    _HN2    19     1.01597   118.77045    -1.69812
   20    18 S   CT1  _CA2    20     1.46263   123.73609   178.72313
   21    20 S   HC   _HA2    21     1.09738   109.29653   -17.65948
   22    20 S   C    _C2_    22     1.53499   107.92430  -133.03399
   23    22 S   O    _O2_    23     1.23007   122.38313  -145.62672
   24    20 S   CT   _CB2    32     1.53480   111.46728   104.88593
   25    24 S   HC   HB21    33     1.09432   109.59088    51.25567
   26    24 S   HC   HB22    34     1.09503   110.71807   169.38209
   27    22 S   N    _N3_    24     1.38558   113.27944    41.79998
   28    27 S   H    _HN3    25     1.01539   118.85760    -0.70638
   29    24 S   S    _SG2    35     1.82995   111.62787   -72.33124
   30    27 S   CT   _CA3    26     1.45441   123.45738   175.05767
   31    30 S   HC   HA31    27     1.09525   109.19923    24.88895
   32    30 S   HC   HA32    28     1.09494   107.12396   141.89442
   33    29 S   CT   _C9_    36     1.86972   101.55586   135.86120
   34    30 S   CO3  _C3_    29     1.52933   113.17441   -98.56021
   35    34 S   O2Z  _O31    30     1.26400   115.44646   -43.30846
   36    34 S   O2Z  _O32    31     1.26361   114.95384   137.63484
   37    33 S   CM   _C8_    37     1.52296   106.20685  -176.42100
   38    33 S   CT   _C10   114     1.53367   109.20660    59.99334
   39    38 S   HC   _H9_   115     1.09487   112.02813   -71.85571
   40    38 S   HC   _H10   116     1.09656   111.39905   168.02258
   41    38 S   HC   _H11   117     1.09663   112.09920    48.70700
   42    37 S   NI   _N4_    38     1.37501   111.02491    91.36827
   43    37 S   CM   _C11    50     1.34480   125.15744   -87.79593
   44    43 S   HC   _H12    51     1.08355   120.42595     0.83087
   45    42 S   CD   _C7_    39     1.30271   109.52533    11.89014
   46    45 S   OM   _O33    40     1.24577   127.93825  -174.40500
   47    43 S   CD   _C12    52     1.48123   122.70747   178.46227
   48    33 S   CT   _C6_    41     1.55078   110.28274   -68.88858
   49    48 S   HC   _H3_    42     1.09597   112.06847    28.62318
   50    47 S   CM   _C33    53     1.47490   118.84707  -154.97890
   51    48 S   CT   _C5_    43     1.54587   114.56171   152.84226
   52    51 S   HC   _H7_    44     1.09489   109.75080   -51.14668
   53    51 S   HC   _H8_    45     1.09657   110.85697    67.29961
   54    50 S   CM   _C32    54     1.34222   101.60362  -179.80719
   55    50 S   CT   _C34   110     1.47977   126.62210     1.50844
   56    55 S   HC   _H34   111     1.09438   110.53723   -66.86287
   57    55 S   HC   _H35   112     1.09371   112.14290   172.88065
   58    55 S   HC   _H36   113     1.09473   110.59429    53.36806
   59    51 S   CT   _C4_    46     1.52584   113.42747  -169.58992
   60    59 S   HC   _H4_    47     1.09266   111.92157   -70.23774
   61    59 S   HC   _H5_    48     1.09499   109.88463   170.69080
   62    59 S   HC   _H6_    49     1.09460   111.17435    51.48183
   63    54 S   CM   _C13    55     1.45695   109.97677     0.34999
   64    54 S   CT   _C35   101     1.50122   125.87873   178.46685
   65    64 S   HC   _H37   102     1.09704   110.19604  -140.08645
   66    64 S   HC   _H38   103     1.09754   109.60478   -25.49421
   67    47 S   NI   _N5_    56     1.29919   126.53531    27.00345
   68    63 S   CM   _C14    57     1.34513   126.60142  -178.68508
   69    68 S   HC   _H13    58     1.08633   118.55843     0.70914
   70    64 S   CT   _C36   104     1.52670   112.42946    96.09329
   71    70 S   HC   _H39   105     1.09781   109.65346   -53.46889
   72    70 S   HC   _H40   106     1.09668   110.23044    64.27817
   73    68 S   C5A  _C15    59     1.42694   125.73509  -179.18507
   74    70 S   CO3  _C37   107     1.53246   114.31160  -174.47891
   75    74 S   O2Z  _O38   108     1.26516   114.18421   167.31427
   76    74 S   O2Z  _O37   109     1.26183   116.61418   -12.54450
   77    73 S   C5BC _C16    60     1.39244   132.47774  -178.29498
   78    77 S   C5BC _C17    61     1.44047   107.34283  -177.85406
   79    77 S   CT   _C29    92     1.50342   126.87510     1.11978
   80    79 S   HC   _H30    93     1.09741   108.34047  -133.12945
   81    79 S   HC   _H31    94     1.09577   110.40656   -18.24903
   82    78 S   C5A  _C18    62     1.38325   107.02780     0.48214
   83    78 S   CT   _C28    88     1.48849   126.78381   179.83098
   84    83 S   HC   _H27    89     1.09451   110.11733    85.04276
   85    83 S   HC   _H28    90     1.09482   111.38864  -154.95643
   86    83 S   HC   _H29    91     1.09410   111.24519   -35.23468
   87    79 S   CT   _C30    95     1.52586   113.34527   106.21487
   88    87 S   HC   _H32    96     1.09730   108.81117   170.47032
   89    87 S   HC   _H33    97     1.09642   110.57617    53.67454
   90    73 S   NA   _N6_    63     1.37506   120.60533     1.91080
   91    90 S   H    _H14    64     1.01280   124.40711    -2.02854
   92    82 S   CM   _C19    65     1.41835   133.46591   179.95154
   93    92 S   HC   _H15    66     1.08394   115.88445    56.04681
   94    87 S   CO3  _C31    98     1.53024   114.35215   -70.57886
   95    94 S   O2Z  _O36    99     1.26217   115.77190   -45.26467
   96    94 S   O2Z  _O35   100     1.26410   114.65360   136.30235
   97    92 S   CM   _C20    67     1.34413   123.13492  -118.94551
   98    97 S   CM   _C21    68     1.45919   128.63938   177.11222
   99    98 S   CT   _C24    69     1.53574   107.44344  -164.55066
  100    98 S   CM   _C22    82     1.34647   129.90741    19.27246
  101   100 S   HC   _H16    83     1.08906   117.52131  -179.55063
  102    99 S   C    _C25    70     1.52564   101.81815   -11.31056
  103   102 S   O    _O34    71     1.22281   125.85668  -173.76036
  104    99 S   CT   _C26    74     1.53211   111.31228   104.66859
  105   104 S   HC   _H21    75     1.09623   111.04329  -173.32427
  106   104 S   HC   _H22    76     1.09569   111.32560    66.54514
  107   104 S   HC   _H23    77     1.09663   111.66130   -54.03790
  108    99 S   CT   _C27    78     1.53147   114.52533  -128.26135
  109   108 S   HC   _H24    79     1.09641   111.07695   173.93657
  110   108 S   HC   _H25    80     1.09513   111.10943    55.08493
  111   108 S   HC   _H26    81     1.09491   112.00213   -66.00441
  112   100 S   CT   _C23    84     1.49347   129.48086     2.72836
  113   112 S   HC   _H17    85     1.09361   110.44105   -95.55790
  114   112 S   HC   _H18    86     1.09548   109.19898   145.93338
  115   112 S   HC   _H19    87     1.09128   113.02326    27.76583
  116    97 S   N    _N7_    72     1.36860   123.71514     2.82431
  117   116 S   H    _H20    73     1.01289   123.38494    -7.18190
  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  12   5   4   3
  17   2   1   1  15   9   3   2   1   8   9   3   7   3  10   8
   4  12   6   5   4  16   6   2   1   1   3   2   1   1  10  10
   5   4   3   8   3   5   4   3  11   2   1   1  16  14  11   5
   4  11   5   2   1   1   5   4   3   4   1   8   3   2   1   1
  11  19  15   9   4  11   4   8   3   2   1   4   2   1   1   3
   2   1   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    48    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    45    48    49    51    43    38    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    45    46    48    49    51    52    53    59    43    44    47    38    39    40    41  
   35    36  
   36  
    0  
   42    45    46    48    49    51    43    44    47    50    67    38    39    40    41  
   39    40    41    42    43    45    48    49    51  
   40    41    48  
   41    48  
   48  
   45    46    48    49    51    43    44    47  
   44    47    50    54    63    67    55    45    48  
   47    50    67  
   46    48    49    51    52    53    59  
   48    49    51  
   50    54    63    67    68    64    55    56    57    58  
   49    51    52    53    59    60    61    62  
   51    52    53    59  
   54    63    67    68    64    65    66    70    55    56    57    58  
   52    53    59    60    61    62  
   53    59    60    61    62  
   59    60    61    62  
   63    67    68    69    73    64    65    66    70    71    72    74    55    56    57    58  
   56    57    58    63    64    67  
   57    58  
   58  
    0  
   60    61    62  
   61    62  
   62  
    0  
   67    68    69    73    77    90    64    65    66    70  
   65    66    70    71    72    74    75    76    67    68  
   66    70    71    72    74  
   70    71    72    74  
   68    69    73  
   69    73    77    78    82    90    91    79  
   73    77    90  
   71    72    74    75    76  
   72    74    75    76  
   74    75    76  
   77    78    82    90    91    92    83    79    80    81    87  
   75    76  
   76  
    0  
   78    82    90    91    92    83    84    85    86    79    80    81    87    88    89    94  
   82    90    91    92    93    97    83    84    85    86    79    80    81    87  
   80    81    87    88    89    94    95    96    82    83    90  
   81    87    88    89    94  
   87    88    89    94  
   90    91    92    93    97    98   116    83    84    85    86  
   84    85    86    90    92  
   85    86  
   86  
    0  
   88    89    94    95    96  
   89    94    95    96  
   94    95    96  
   91    92    93    97  
   92  
   93    97    98    99   102   116   117   100  
   97    98   116  
   95    96  
   96  
    0  
   98    99   102   103   116   117   104   108   100   101   112  
   99   102   103   116   117   104   105   106   107   108   109   110   111   100   101   112   113   114   115  
  102   103   116   117   104   105   106   107   108   109   110   111   100   101   112  
  101   112   113   114   115   102   104   108   116  
  112   113   114   115  
  103   116   117   104   105   106   107   108   109   110   111  
  116   117   104   108  
  105   106   107   108   109   110   111   116  
  106   107   108  
  107   108  
  108  
  109   110   111   116  
  110   111  
  111  
    0  
  113   114   115  
  114   115  
  115  
    0  
  117  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.2800   0.1700  -0.912200   1.8540   1.6400   0.005000000   0.000000000
   43   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
   44   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   45   3.7500   0.1050   0.438600   2.0020   1.7750   0.023028004  -0.852763146
   46   3.1500   0.2500  -0.685000   1.7825   1.5750   0.001000000  -0.126889456
   47   3.7500   0.1050   0.396300   2.0020   1.7750   0.023028004  -0.852763146
   48   3.5000   0.0660  -0.023900   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760  -0.003300   2.0020   1.7750   0.023028004  -0.852763146
   51   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   68   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   69   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   73   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   74   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   77   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   78   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   79   3.5000   0.0660  -0.005000   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   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   83   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   90   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   91   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   92   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   93   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   94   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   95   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   96   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   97   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   98   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   99   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
  100   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  101   2.4200   0.0300   0.115000   1.4250   1.2500   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  116   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  117   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.510
   33    48   268.000  1.529
   33    38   268.000  1.529
   37    42   405.000  1.380
   37    43   549.000  1.340
   42    45   500.000  1.261
   45    46   795.000  1.237
   45    48   270.000  1.508
   48    49   340.000  1.090
   48    51   268.000  1.529
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    59   268.000  1.529
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   43    44   340.000  1.080
   43    47   320.000  1.464
   47    50   320.000  1.464
   47    67   500.000  1.261
   50    54   549.000  1.340
   50    55   317.000  1.510
   54    63   380.000  1.444
   54    64   317.000  1.510
   63    67   405.000  1.380
   63    68   549.000  1.340
   68    69   340.000  1.080
   68    73   375.000  1.423
   73    77   546.000  1.367
   73    90   427.000  1.381
   77    78   469.000  1.424
   77    79   285.000  1.502
   78    82   546.000  1.367
   78    83   285.000  1.502
   82    90   427.000  1.381
   82    92   375.000  1.423
   90    91   434.000  1.010
   92    93   340.000  1.080
   92    97   549.000  1.340
   97    98   380.000  1.444
   97   116   400.000  1.384
   98    99   317.000  1.510
   98   100   549.000  1.340
   99   102   317.000  1.522
   99   104   268.000  1.529
   99   108   268.000  1.529
  102   103   570.000  1.229
  102   116   490.000  1.335
  116   117   434.000  1.010
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   340.000  1.090
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   340.000  1.090
  100   101   340.000  1.080
  100   112   317.000  1.510
  112   113   340.000  1.090
  112   114   340.000  1.090
  112   115   340.000  1.090
   83    84   340.000  1.090
   83    85   340.000  1.090
   83    86   340.000  1.090
   79    80   340.000  1.090
   79    81   340.000  1.090
   79    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    94   317.000  1.522
   94    95   656.000  1.250
   94    96   656.000  1.250
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    74   317.000  1.522
   74    75   656.000  1.250
   74    76   656.000  1.250
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  112.20000
   29    33    48    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    42    65.00000  119.96000
   33    37    43    70.00000  124.00000
   33    48    45    70.00000  111.76100
   33    48    49    37.50000  110.70000
   33    48    51    58.35000  112.70000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   37    42    45    75.00000  115.77100
   37    43    44    35.00000  120.00000
   37    43    47    60.00000  120.31500
   42    45    46    75.00000  134.47000
   42    45    48    65.00000  122.10100
   45    48    49    45.00000  109.49600
   45    48    51    70.00000  111.76100
   48    33    37    70.00000  112.02700
   48    45    46    75.00000  122.80800
   48    51    52    37.50000  110.70000
   48    51    53    37.50000  110.70000
   48    51    59    58.35000  112.70000
   51    48    49    37.50000  110.70000
   51    59    60    37.50000  110.70000
   51    59    61    37.50000  110.70000
   51    59    62    37.50000  110.70000
   53    51    52    33.00000  107.80000
   59    51    52    37.50000  110.70000
   59    51    53    37.50000  110.70000
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   43    37    42    70.00000  120.83400
   43    47    50    65.00000  123.36000
   43    47    67    70.00000  121.86000
   47    43    44    40.00000  114.85300
   47    50    54    60.00000  120.31500
   47    50    55    65.00000  117.22000
   47    67    63    75.00000  115.77100
   50    54    63    70.00000  123.01800
   50    54    64    70.00000  124.00000
   50    55    56    35.00000  109.50000
   50    55    57    35.00000  109.50000
   50    55    58    35.00000  109.50000
   54    63    67    70.00000  120.83400
   54    63    68    70.00000  123.01800
   54    64    65    35.00000  109.50000
   54    64    66    35.00000  109.50000
   54    64    70    70.00000  112.02700
   63    68    69    35.00000  120.00000
   63    68    73    55.00000  128.24000
   67    47    50    70.00000  121.86000
   68    63    67    70.00000  120.83400
   68    73    77    50.00000  133.16000
   68    73    90    70.00000  120.38000
   73    68    69    40.00000  117.26300
   73    77    78    70.00000  107.30000
   73    77    79    60.00000  130.00000
   73    90    82    70.00000  109.80000
   73    90    91    35.00000  120.00000
   77    78    82    70.00000  107.30000
   77    78    83    60.00000  130.00000
   77    79    80    35.00000  109.50000
   77    79    81    35.00000  109.50000
   77    79    87    70.00000  112.17500
   78    82    90    70.00000  107.70000
   78    82    92    50.00000  133.16000
   78    83    84    35.00000  109.50000
   78    83    85    35.00000  109.50000
   78    83    86    35.00000  109.50000
   82    90    91    35.00000  120.00000
   82    92    93    40.00000  117.26300
   82    92    97    55.00000  128.24000
   90    73    77    70.00000  107.70000
   92    82    90    70.00000  120.38000
   92    97    98    70.00000  123.01800
   92    97   116    75.00000  120.83300
   97    92    93    35.00000  120.00000
   97    98    99    70.00000  124.00000
   97    98   100    70.00000  123.01800
   97   116   102    70.00000  120.89900
   97   116   117    45.00000  117.55000
   98    99   102    70.00000  115.00700
   98    99   104    70.00000  112.02700
   98    99   108    70.00000  112.02700
   98   100   101    35.00000  120.00000
   98   100   112    70.00000  124.00000
   99   102   103    80.00000  120.40000
   99   102   116    70.00000  116.60000
   99   104   105    37.50000  110.70000
   99   104   106    37.50000  110.70000
   99   104   107    37.50000  110.70000
   99   108   109    37.50000  110.70000
   99   108   110    37.50000  110.70000
   99   108   111    37.50000  110.70000
  102   116   117    35.00000  119.80000
  116    97    98    75.00000  120.83300
  116   102   103    80.00000  122.90000
  104    99   102    63.00000  111.10000
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
  108    99   102    63.00000  111.10000
  108    99   104    58.35000  112.70000
  110   108   109    33.00000  107.80000
  111   108   109    33.00000  107.80000
  111   108   110    33.00000  107.80000
  100    98    99    70.00000  124.00000
  100   112   113    35.00000  109.50000
  100   112   114    35.00000  109.50000
  100   112   115    35.00000  109.50000
  112   100   101    35.00000  117.00000
  114   112   113    33.00000  107.80000
  115   112   113    33.00000  107.80000
  115   112   114    33.00000  107.80000
   83    78    82    60.00000  130.00000
   85    83    84    33.00000  107.80000
   86    83    84    33.00000  107.80000
   86    83    85    33.00000  107.80000
   79    77    78    60.00000  130.00000
   79    87    88    37.50000  110.70000
   79    87    89    37.50000  110.70000
   79    87    94    70.00000  109.69300
   81    79    80    33.00000  107.80000
   87    79    80    37.50000  110.70000
   87    79    81    37.50000  110.70000
   87    94    95    70.00000  117.00000
   87    94    96    70.00000  117.00000
   89    87    88    33.00000  107.80000
   94    87    88    35.00000  109.50000
   94    87    89    35.00000  109.50000
   96    94    95    80.00000  126.00000
   64    54    63    70.00000  124.00000
   64    70    71    37.50000  110.70000
   64    70    72    37.50000  110.70000
   64    70    74    70.00000  109.69300
   66    64    65    33.00000  107.80000
   70    64    65    37.50000  110.70000
   70    64    66    37.50000  110.70000
   70    74    75    70.00000  117.00000
   70    74    76    70.00000  117.00000
   72    70    71    33.00000  107.80000
   74    70    71    35.00000  109.50000
   74    70    72    35.00000  109.50000
   76    74    75    80.00000  126.00000
   55    50    54    70.00000  124.00000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    48    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   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    37    42   0.09700  1.0 1.0
   29    33    37    42   0.15600 -1.0 2.0
   29    33    37    42  -0.50800  1.0 3.0
   29    33    37    43   0.42700  1.0 1.0
   29    33    37    43  -0.70350 -1.0 2.0
   29    33    37    43  -0.43150  1.0 3.0
   29    33    48    45   0.56750  1.0 1.0
   29    33    48    45  -0.07550 -1.0 2.0
   29    33    48    45   0.20000  1.0 3.0
   29    33    48    49   0.15000  1.0 3.0
   29    33    48    51   0.44750  1.0 1.0
   29    33    48    51  -0.17800 -1.0 2.0
   29    33    48    51   0.20200  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.15000  1.0 3.0
   33    37   -42    45   1.00000 -1.0 2.0
   33    37    43    44   7.00000 -1.0 2.0
   33    37    43    47   7.00000 -1.0 2.0
   33    48    51    52   0.15000  1.0 3.0
   33    48    51    53   0.15000  1.0 3.0
   33    48    51    59   0.56750  1.0 1.0
   33    48    51    59  -0.07550 -1.0 2.0
   33    48    51    59   0.20000  1.0 3.0
   37    33   -48    45   0.31000  1.0 1.0
   37    33   -48    45   0.14700 -1.0 2.0
   37    33   -48    45   0.07550  1.0 3.0
   37    33    48    49   0.15000  1.0 3.0
   37    33    48    51   0.34400  1.0 1.0
   37    33    48    51   0.09450 -1.0 2.0
   37    33    48    51   0.11100  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    41   0.15000  1.0 3.0
   37    42    45    46   6.00000 -1.0 2.0
   37    42   -45    48   6.00000 -1.0 2.0
   37    43    47    50   0.69550 -1.0 2.0
   37    43    47    67   1.09650  1.0 1.0
   37    43    47    67   0.48950 -1.0 2.0
   37    43    47    67   0.49400  1.0 3.0
   42    37    43    44   7.00000 -1.0 2.0
   42    37    43    47   7.00000 -1.0 2.0
   42    45   -48    33   0.00000  1.0 1.0
   42    45    48    49   0.00000  1.0 1.0
   42    45    48    51   0.00000  1.0 1.0
   45    48    51    52   0.15000  1.0 3.0
   45    48    51    53   0.15000  1.0 3.0
   45    48    51    59   0.34400  1.0 1.0
   45    48    51    59   0.09450 -1.0 2.0
   45    48    51    59   0.11100  1.0 3.0
   46    45    48    33   0.00000  1.0 1.0
   46    45    48    49   0.00000  1.0 1.0
   46    45    48    51   0.00000  1.0 1.0
   48    33   -37    42   0.09700  1.0 1.0
   48    33   -37    42   0.15600 -1.0 2.0
   48    33   -37    42  -0.50800  1.0 3.0
   48    33    37    43   0.09850  1.0 1.0
   48    33    37    43   0.15250 -1.0 2.0
   48    33    37    43  -0.50650  1.0 3.0
   48    33    38    39   0.15000  1.0 3.0
   48    33    38    40   0.15000  1.0 3.0
   48    33    38    41   0.15000  1.0 3.0
   48    51    59    60   0.15000  1.0 3.0
   48    51    59    61   0.15000  1.0 3.0
   48    51    59    62   0.15000  1.0 3.0
   49    48    51    52   0.15000  1.0 3.0
   49    48    51    53   0.15000  1.0 3.0
   49    48    51    59   0.15000  1.0 3.0
   52    51    59    60   0.15000  1.0 3.0
   52    51    59    61   0.15000  1.0 3.0
   52    51    59    62   0.15000  1.0 3.0
   53    51    59    60   0.15000  1.0 3.0
   53    51    59    61   0.15000  1.0 3.0
   53    51    59    62   0.15000  1.0 3.0
   43    37    42    45   1.00000 -1.0 2.0
   43    47    50    54   0.69550 -1.0 2.0
   43    47    50    55   7.00000 -1.0 2.0
   43    47    67    63   6.00000 -1.0 2.0
   44    43    47    50   0.00000  1.0 1.0
   44    43    47    67   1.00600 -1.0 2.0
   47    50   -54    63   7.00000 -1.0 2.0
   47    50    54    64   7.00000 -1.0 2.0
   47    50    55    56   0.00000  1.0 1.0
   47    50    55    57   0.00000  1.0 1.0
   47    50    55    58   0.00000  1.0 1.0
   50    47   -67    63   6.00000 -1.0 2.0
   50    54   -63    67  -0.18600  1.0 3.0
   50    54    63    68   0.28850  1.0 1.0
   50    54    63    68   2.61350 -1.0 2.0
   50    54    63    68   0.78400  1.0 3.0
   50    54    64    65   0.00000  1.0 1.0
   50    54    64    66   0.00000  1.0 1.0
   50    54    64    70   0.09850  1.0 1.0
   50    54    64    70   0.15250 -1.0 2.0
   50    54    64    70  -0.50650  1.0 3.0
   54    50    55    56   0.00000  1.0 1.0
   54    50    55    57   0.00000  1.0 1.0
   54    50    55    58   0.00000  1.0 1.0
   54    63   -67    47   1.00000 -1.0 2.0
   54    63    68    69   7.00000 -1.0 2.0
   54    63    68    73   7.00000 -1.0 2.0
   54    64    70    71   0.15000  1.0 3.0
   54    64    70    72   0.15000  1.0 3.0
   54    64    70    74  -0.98800  1.0 1.0
   54    64    70    74   0.48800 -1.0 2.0
   54    64    70    74   0.76800  1.0 3.0
   63    54    64    65   0.00000  1.0 1.0
   63    54    64    66   0.00000  1.0 1.0
   63    54    64    70   0.98200  1.0 1.0
   63    54    64    70  -0.11900 -1.0 2.0
   63    54    64    70   0.24250  1.0 3.0
   63    68    73    77   0.15800  1.0 1.0
   63    68    73    77   1.85350 -1.0 2.0
   63    68    73    77  -0.48700  1.0 3.0
   63    68    73    90   0.11450  1.0 1.0
   63    68    73    90   1.85100 -1.0 2.0
   63    68    73    90  -0.49050  1.0 3.0
   67    47   -50    54   1.09650  1.0 1.0
   67    47   -50    54   0.48950 -1.0 2.0
   67    47   -50    54   0.49400  1.0 3.0
   67    47    50    55   7.00000 -1.0 2.0
   67    63    68    69   7.00000 -1.0 2.0
   67    63    68    73   7.00000 -1.0 2.0
   68    63    67    47   1.00000 -1.0 2.0
   68    73    77    78   3.62500 -1.0 2.0
   68    73    77    79   3.62500 -1.0 2.0
   68    73    90    82   3.62500 -1.0 2.0
   68    73    90    91   2.00000 -1.0 2.0
   69    68    73    77   0.56550  1.0 3.0
   69    68    73    90   0.54250  1.0 3.0
   73    77   -78    82   3.62500 -1.0 2.0
   73    77    78    83   3.62500 -1.0 2.0
   73    77    79    80   0.00000  1.0 1.0
   73    77    79    81   0.00000  1.0 1.0
   73    77    79    87   0.04150 -1.0 2.0
   77    73   -90    82   3.62500 -1.0 2.0
   77    73    90    91   2.00000 -1.0 2.0
   77    78   -82    90   3.62500 -1.0 2.0
   77    78    82    92   3.62500 -1.0 2.0
   77    78    83    84   0.00000  1.0 1.0
   77    78    83    85   0.00000  1.0 1.0
   77    78    83    86   0.00000  1.0 1.0
   77    79    87    88   0.43200  1.0 3.0
   77    79    87    89   0.43200  1.0 3.0
   77    79    87    94  -2.95950  1.0 1.0
   77    79    87    94   0.02300  1.0 3.0
   78    77    79    80   0.00000  1.0 1.0
   78    77    79    81   0.00000  1.0 1.0
   78    77    79    87   0.04150 -1.0 2.0
   78    82   -90    73   3.62500 -1.0 2.0
   78    82    90    91   2.00000 -1.0 2.0
   78    82    92    93   0.56550  1.0 3.0
   78    82    92    97   0.15800  1.0 1.0
   78    82    92    97   1.85350 -1.0 2.0
   78    82    92    97  -0.48700  1.0 3.0
   82    78    83    84   0.00000  1.0 1.0
   82    78    83    85   0.00000  1.0 1.0
   82    78    83    86   0.00000  1.0 1.0
   82    92    97    98   7.00000 -1.0 2.0
   82    92    97   116   7.00000 -1.0 2.0
   90    73   -77    78   3.62500 -1.0 2.0
   90    73    77    79   3.62500 -1.0 2.0
   90    82    92    93   0.54250  1.0 3.0
   90    82    92    97   0.11450  1.0 1.0
   90    82    92    97   1.85100 -1.0 2.0
   90    82    92    97  -0.49050  1.0 3.0
   92    82    90    73   3.62500 -1.0 2.0
   92    82    90    91   2.00000 -1.0 2.0
   92    97    98    99  -0.18600  1.0 3.0
   92    97    98   100   0.28850  1.0 1.0
   92    97    98   100   2.61350 -1.0 2.0
   92    97    98   100   0.78400  1.0 3.0
   92    97   116   102  -0.18900  1.0 1.0
   92    97   116   102   1.70900 -1.0 2.0
   92    97   116   117   0.78350 -1.0 2.0
   93    92    97    98   7.00000 -1.0 2.0
   93    92    97   116   7.00000 -1.0 2.0
   97    98   -99   102  -0.51250  1.0 1.0
   97    98   -99   102  -0.88800 -1.0 2.0
   97    98   -99   102   0.08850  1.0 3.0
   97    98    99   104   0.98200  1.0 1.0
   97    98    99   104  -0.11900 -1.0 2.0
   97    98    99   104   0.24250  1.0 3.0
   97    98    99   108   0.98200  1.0 1.0
   97    98    99   108  -0.11900 -1.0 2.0
   97    98    99   108   0.24250  1.0 3.0
   97    98   100   101   7.00000 -1.0 2.0
   97    98   100   112   7.00000 -1.0 2.0
   98    97  -116   102  -0.18900  1.0 1.0
   98    97  -116   102   1.70900 -1.0 2.0
   98    97   116   117   0.78350 -1.0 2.0
   98    99   102   103   0.30150 -1.0 2.0
   98    99  -102   116   0.00000  1.0 1.0
   98    99   104   105   0.15000  1.0 3.0
   98    99   104   106   0.15000  1.0 3.0
   98    99   104   107   0.15000  1.0 3.0
   98    99   108   109   0.15000  1.0 3.0
   98    99   108   110   0.15000  1.0 3.0
   98    99   108   111   0.15000  1.0 3.0
   98   100   112   113   0.00000  1.0 1.0
   98   100   112   114   0.00000  1.0 1.0
   98   100   112   115   0.00000  1.0 1.0
   99    98   100   101   7.00000 -1.0 2.0
   99    98   100   112   7.00000 -1.0 2.0
   99   102  -116    97   0.67100  1.0 1.0
   99   102  -116    97   1.42150 -1.0 2.0
   99   102  -116    97   0.18700  1.0 3.0
   99   102   116   117   2.45000 -1.0 2.0
  102    99   104   105  -0.11250  1.0 3.0
  102    99   104   106  -0.11250  1.0 3.0
  102    99   104   107  -0.11250  1.0 3.0
  102    99   108   109  -0.11250  1.0 3.0
  102    99   108   110  -0.11250  1.0 3.0
  102    99   108   111  -0.11250  1.0 3.0
  103   102   116    97   2.67200 -1.0 2.0
  103   102   116   117   2.45000 -1.0 2.0
  116    97   -98    99   1.08500 -1.0 2.0
  116    97    98   100  -0.18600  1.0 3.0
  104    99   102   103   0.30150 -1.0 2.0
  104    99   102   116   1.39750  1.0 1.0
  104    99   102   116  -0.07950 -1.0 2.0
  104    99   102   116  -0.18750  1.0 3.0
  104    99   108   109   0.15000  1.0 3.0
  104    99   108   110   0.15000  1.0 3.0
  104    99   108   111   0.15000  1.0 3.0
  108    99   102   103   0.30150 -1.0 2.0
  108    99   102   116   1.39750  1.0 1.0
  108    99   102   116  -0.07950 -1.0 2.0
  108    99   102   116  -0.18750  1.0 3.0
  108    99   104   105   0.15000  1.0 3.0
  108    99   104   106   0.15000  1.0 3.0
  108    99   104   107   0.15000  1.0 3.0
  100    98    99   102  -0.51250  1.0 1.0
  100    98    99   102  -0.88800 -1.0 2.0
  100    98    99   102   0.08850  1.0 3.0
  100    98    99   104   0.09850  1.0 1.0
  100    98    99   104   0.15250 -1.0 2.0
  100    98    99   104  -0.50650  1.0 3.0
  100    98    99   108   0.09850  1.0 1.0
  100    98    99   108   0.15250 -1.0 2.0
  100    98    99   108  -0.50650  1.0 3.0
  101   100   112   113   0.33100  1.0 3.0
  101   100   112   114   0.33100  1.0 3.0
  101   100   112   115   0.33100  1.0 3.0
   83    78    82    90   3.62500 -1.0 2.0
   83    78    82    92   3.62500 -1.0 2.0
   79    77    78    82   3.62500 -1.0 2.0
   79    77    78    83   3.62500 -1.0 2.0
   79    87    94    95   0.41150 -1.0 2.0
   79    87    94    96   0.41150 -1.0 2.0
   80    79    87    88   0.15000  1.0 3.0
   80    79    87    89   0.15000  1.0 3.0
   80    79    87    94  -0.11250  1.0 3.0
   81    79    87    88   0.15000  1.0 3.0
   81    79    87    89   0.15000  1.0 3.0
   81    79    87    94  -0.11250  1.0 3.0
   88    87    94    95   0.00000  1.0 1.0
   88    87    94    96   0.00000  1.0 1.0
   89    87    94    95   0.00000  1.0 1.0
   89    87    94    96   0.00000  1.0 1.0
   64    54    63    67   1.08500 -1.0 2.0
   64    54    63    68  -0.18600  1.0 3.0
   64    70    74    75   0.41150 -1.0 2.0
   64    70    74    76   0.41150 -1.0 2.0
   65    64    70    71   0.15000  1.0 3.0
   65    64    70    72   0.15000  1.0 3.0
   65    64    70    74  -0.11250  1.0 3.0
   66    64    70    71   0.15000  1.0 3.0
   66    64    70    72   0.15000  1.0 3.0
   66    64    70    74  -0.11250  1.0 3.0
   71    70    74    75   0.00000  1.0 1.0
   71    70    74    76   0.00000  1.0 1.0
   72    70    74    75   0.00000  1.0 1.0
   72    70    74    76   0.00000  1.0 1.0
   55    50    54    63   7.00000 -1.0 2.0
   55    50    54    64   7.00000 -1.0 2.0
   38    33    37    42   0.09700  1.0 1.0
   38    33    37    42   0.15600 -1.0 2.0
   38    33    37    42  -0.50800  1.0 3.0
   38    33    37    43   0.09850  1.0 1.0
   38    33    37    43   0.15250 -1.0 2.0
   38    33    37    43  -0.50650  1.0 3.0
   38    33    48    45   0.34400  1.0 1.0
   38    33    48    45   0.09450 -1.0 2.0
   38    33    48    45   0.11100  1.0 3.0
   38    33    48    49   0.15000  1.0 3.0
   38    33    48    51   0.56750  1.0 1.0
   38    33    48    51  -0.07550 -1.0 2.0
   38    33    48    51   0.20000  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
   35    30    34    36  10.50000 -1.0 2.0
   33    42    37    43   1.10000 -1.0 2.0
   48    46    45    42  10.50000 -1.0 2.0
   47    44    43    37   1.10000 -1.0 2.0
   43    50    47    67  10.50000 -1.0 2.0
   47    55    50    54   1.10000 -1.0 2.0
   63    64    54    50   1.10000 -1.0 2.0
   54    67    63    68   1.10000 -1.0 2.0
   73    69    68    63   1.10000 -1.0 2.0
   77    90    73    68   4.00000 -1.0 2.0
   78    79    77    73   4.00000 -1.0 2.0
   82    83    78    77   4.00000 -1.0 2.0
   92    90    82    78   4.00000 -1.0 2.0
   91    73    90    82   1.00000 -1.0 2.0
   82    93    92    97   1.10000 -1.0 2.0
   98   116    97    92   1.10000 -1.0 2.0
   97    99    98   100   1.10000 -1.0 2.0
   99   116   102   103  10.50000 -1.0 2.0
  117   102   116    97   1.00000 -1.0 2.0
  112   101   100    98   1.10000 -1.0 2.0
   95    87    94    96  10.50000 -1.0 2.0
   75    70    74    76  10.50000 -1.0 2.0
END
