* LIGAND DATABASE FILE (OPLS2005)
*
001     126   128    233    359     689
    1     0 S   NP   _N1_     1    28.64777    97.45653   -24.68623
    2     1 S   H    _HN1     2     1.02786   108.07526   -80.28709
    3     1 S   H    _H1_     3     1.02947    64.06605    21.86218
    4     1 S   H    _H2_     4     1.02827    45.25459  -177.85634
    5     1 S   CT   _CA1     5     1.50129   138.54314   113.83666
    6     5 S   HC   _HA1     6     1.09578   105.13828   104.09143
    7     5 S   CO3  _C1_     7     1.53758   112.52934   -16.01478
    8     7 S   O2Z  _O11     8     1.26373   114.98154   -40.72586
    9     7 S   O2Z  _O12     9     1.26239   114.93479   138.25125
   10     5 S   CT   _CB1    10     1.53068   107.40775  -137.98426
   11    10 S   HC   HB11    11     1.09834   109.23003   -49.82774
   12    10 S   HC   HB12    12     1.09807   110.52295    66.76977
   13    10 S   CT   _CG1    13     1.52973   112.61965  -170.81153
   14    13 S   HC   HG11    14     1.09587   110.69369   -68.54494
   15    13 S   HC   HG12    15     1.09681   109.70060    50.64813
   16    13 S   C    _CD1    16     1.51822   112.20424   170.96545
   17    16 S   O    _OE1    17     1.22721   123.32838     9.49935
   18    16 S   N    _N2_    18     1.38576   111.57611  -170.29125
   19    18 S   H    _HN2    19     1.01514   118.83257     1.17503
   20    18 S   CT1  _CA2    20     1.46144   123.67103   176.31045
   21    20 S   HC   _HA2    21     1.09720   109.43109     4.41677
   22    20 S   C    _C2_    22     1.53659   108.68490  -111.16419
   23    22 S   O    _O2_    23     1.23076   122.22617  -150.80862
   24    20 S   CT   _CB2    32     1.53258   111.30070   126.74710
   25    24 S   HC   HB21    33     1.09303   109.67428    54.90721
   26    24 S   HC   HB22    34     1.09491   110.25478   173.61847
   27    22 S   N    _N3_    24     1.38293   113.86079    36.60856
   28    27 S   H    _HN3    25     1.01563   119.53981    -3.32914
   29    24 S   S    _SG2    35     1.82757   111.47185   -67.12778
   30    27 S   CT   _CA3    26     1.45274   123.33061   177.36196
   31    30 S   HC   HA31    27     1.09545   107.50906   -65.10619
   32    30 S   HC   HA32    28     1.09555   108.01123    51.37200
   33    29 S   CT   _C18    36     1.87454   101.32330   160.88215
   34    30 S   CO3  _C3_    29     1.52978   113.99587   173.35518
   35    34 S   O2Z  _O31    30     1.26388   116.04929    -0.71272
   36    34 S   O2Z  _O32    31     1.26422   114.42357   179.35018
   37    33 S   CM   _C19    37     1.51686   106.57390   -91.00228
   38    33 S   OH   _O37   125     1.43134   110.00523    28.18852
   39    38 S   HO   _H22   126     0.97041   107.03164    46.23663
   40    37 S   CMA  _C20    38     1.35670   123.06114   -92.40781
   41    40 S   OM   _O35    39     1.26294   130.06522  -173.12186
   42    37 S   CO4  _C21   113     1.50258   118.83834    92.15949
   43    42 S   O    _O36   114     1.23001   120.53188    61.79247
   44    40 S   CM   _C15    40     1.50103   117.57149     6.52907
   45    42 S   CT   _C22   115     1.52286   117.24064  -118.40220
   46    45 S   HC   _H15   116     1.09555   109.21481    26.79449
   47    45 S   HC   _H16   117     1.09525   108.22471   -90.85283
   48    44 S   CMA  _C16    41     1.37051   121.49069   -23.58725
   49    48 S   OM   _O38    42     1.26566   129.67914   179.21267
   50    44 S   CT   _C14    52     1.54901   118.81103   152.84024
   51    50 S   HC   _H13    53     1.09674   113.37006    -3.15231
   52    50 S   HC   _H14    54     1.09826   106.30517  -115.04306
   53    45 S   CT   _C23   118     1.52696   111.90428   148.30852
   54    53 S   HC   _H17   119     1.09647   110.03086    59.75608
   55    53 S   HC   _H18   120     1.09572   110.12972   -57.53143
   56    33 S   CT   _C17    43     1.58715   112.34035   148.56355
   57    50 S   CA   _C12    55     1.52659   115.87709   121.08365
   58    53 S   CT   _C24   121     1.52023   111.47624  -179.10671
   59    58 S   HC   _H19   122     1.09423   111.16705    59.86623
   60    58 S   HC   _H20   123     1.09445   110.25039   179.67857
   61    58 S   HC   _H21   124     1.09469   110.94749   -60.62655
   62    56 S   CT   _C25    44     1.56787   109.68654   -56.97484
   63    62 S   HC   _H23    45     1.09507   111.67492   -53.20349
   64    62 S   HC   _H24    46     1.09741   111.48154  -171.50031
   65    62 S   HC   _H25    47     1.09496   112.47142    68.09476
   66    56 S   CT   _C26    48     1.56249   110.29282  -171.92032
   67    66 S   HC   _H26    49     1.09584   111.46148    62.19788
   68    66 S   HC   _H27    50     1.09473   112.59676   -58.53886
   69    66 S   HC   _H28    51     1.09690   111.07937  -178.55884
   70    57 S   CA   _C13    56     1.40850   120.04818   118.52861
   71    70 S   CA   _C8_    57     1.40444   121.18853  -176.81113
   72    70 S   OH   _O34   111     1.37411   117.88010     2.58861
   73    72 S   HO   _H12   112     0.97198   109.82637   172.18229
   74    71 S   CA   _C9_    58     1.40134   119.92454    -2.81446
   75    71 S   CO4  _C7_    99     1.48569   119.36006   176.96572
   76    75 S   O    _O33   100     1.22849   118.73047    49.14032
   77    74 S   CA   _C10    59     1.40607   120.62915     0.66234
   78    74 S   OH   _O44    97     1.37125   117.73512  -177.55720
   79    78 S   HO   _H45    98     0.96923   110.92191  -177.41684
   80    75 S   CT   _C6_   101     1.51783   118.35363  -129.19642
   81    80 S   HC   _H10   102     1.09588   109.62985    20.03859
   82    80 S   HC   _H11   103     1.09536   108.27276   -98.22559
   83    57 S   CA   _C11    60     1.41011   122.40580   -62.00284
   84    77 S   CT   _C27    63     1.51917   121.60610   179.56795
   85    84 S   HC   _H30    64     1.09805   108.35127    45.69534
   86    84 S   HC   _H31    65     1.09667   110.60589   158.55875
   87    80 S   CT   _C5_   104     1.52719   111.03980   140.75552
   88    87 S   HC   _H8_   105     1.09651   110.07183    60.95105
   89    87 S   HC   _H9_   106     1.09667   109.85811   -56.28922
   90    83 S   OH   _O39    61     1.37158   121.47014    -2.98524
   91    90 S   HO   _H29    62     0.97323   110.42368    -1.10394
   92    84 S   CT   _C28    66     1.53548   112.67402   -77.49778
   93    92 S   HC   _H3_    67     1.09882   110.78629    41.01158
   94    87 S   CT   _C4_   107     1.51986   111.51067  -177.75764
   95    94 S   HC   _H5_   108     1.09468   111.01064    60.46534
   96    94 S   HC   _H6_   109     1.09468   110.98149   -60.05513
   97    94 S   HC   _H7_   110     1.09448   110.26740  -179.80416
   98    92 S   CO4  _C29    68     1.51361   109.61927   157.00088
   99    98 S   O    _O40    69     1.23304   120.61798   -95.01598
  100    98 S   CT   _C30    70     1.51465   118.44908    81.37427
  101   100 S   HC   _H4_    71     1.09779   105.50842   124.80902
  102   100 S   CO4  _C31    72     1.51894   113.54093     8.96988
  103   102 S   O    _O41    73     1.23231   120.84578  -148.42485
  104   100 S   CO4  _C36    85     1.52348   111.19897  -118.42843
  105   104 S   O    _O43    86     1.23106   121.13796    42.73418
  106   102 S   CT   _C32    74     1.53069   117.19844    36.52898
  107   104 S   CT   _C37    87     1.52042   116.36637  -138.42435
  108   107 S   HC   _H38    88     1.09568   107.80857    61.48616
  109   107 S   HC   _H39    89     1.09539   108.13003   -55.71794
  110    92 S   CO4  _C33    75     1.51854   112.29202   -77.11917
  111   110 S   O    _O42    76     1.23323   120.10875    91.72048
  112   106 S   CT   _C34    77     1.53574   109.59272  -165.39910
  113   112 S   HC   _H32    78     1.09557   111.81337   177.48877
  114   112 S   HC   _H33    79     1.09507   111.11373    57.34034
  115   112 S   HC   _H34    80     1.09621   111.39055   -62.19684
  116   106 S   CT   _C35    81     1.53416   108.18564    75.23431
  117   116 S   HC   _H35    82     1.09613   111.36081   174.34605
  118   116 S   HC   _H36    83     1.09599   111.28598    53.81550
  119   116 S   HC   _H37    84     1.09612   111.49203   -66.15239
  120   107 S   CT   _C38    90     1.52578   112.50203  -177.18506
  121   120 S   HC   _H40    91     1.09656   109.96393   -58.77442
  122   120 S   HC   _H41    92     1.09658   109.93513    58.53177
  123   120 S   CT   _C39    93     1.51988   111.50458   179.88131
  124   123 S   HC   _H42    94     1.09469   110.99830   -60.27562
  125   123 S   HC   _H43    95     1.09449   110.26709   180.00000
  126   123 S   HC   _H44    96     1.09468   110.99716    60.24476
  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  10   5   4   3
  20   2   1   1  16   7   1  12   4  10   4  11   9   5   4  14
   4  10   4   3   6   5   4   8  11   3   2   1   1   7   3   2
   1   3   2   1   1  11  14   4   1  12  10   4  12   3   1   9
   5   4   6  11   5   4   6   5   4   1   1  12   6   3   2   1
   1  11   5  13   6  15   5   9   4  10   9   5   4   9   2   7
   3   2   1   3   2   1   1   6   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    56    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    40    48    56    62    66    42    38    39  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    40    41    44    48    49    56    62    63    64    65    66    67    68    69    42    43    45    38    39  
   35    36  
   36  
    0  
   40    41    44    48    56    62    66    50    42    43    45    46    47    53    38    39  
   39    40    42    48    56    62    66  
   56  
   41    44    48    49    56    50    51    52    57    42    43    45  
   44    48    50    42  
   43    45    46    47    53    54    55    58    44    56  
   45    46    47    53  
   48    49    56    62    66    50    51    52    57    70    83  
   46    47    53    54    55    58    59    60    61  
   47    53    54    55    58  
   53    54    55    58  
   49    56    62    63    64    65    66    67    68    69    50    51    52    57  
   56    62    66    50  
   51    52    57    70    71    77    83    90    72    56  
   52    57    70    83  
   57    70    83  
   54    55    58    59    60    61  
   55    58    59    60    61  
   58    59    60    61  
   62    63    64    65    66    67    68    69  
   70    71    74    77    83    90    91    84    75    72    73  
   59    60    61  
   60    61  
   61  
    0  
   63    64    65    66    67    68    69  
   64    65    66  
   65    66  
   66  
   67    68    69  
   68    69  
   69  
    0  
   71    74    77    83    90    78    75    76    80    72    73  
   74    77    83    84    78    79    75    76    80    81    82    87    72    73  
   73    74    75    83  
    0  
   77    83    90    84    85    86    92    78    79    75    76    80  
   76    80    81    82    87    88    89    94    77    78  
   80    81    82    87  
   83    90    91    84    85    86    92    93    98   110    78    79  
   79    83    84  
    0  
   81    82    87    88    89    94    95    96    97  
   82    87    88    89    94  
   87    88    89    94  
   90    91    84    85    86    92  
   85    86    92    93    98    99   100   106   110   111    90  
   86    92    93    98   110  
   92    93    98   110  
   88    89    94    95    96    97  
   89    94    95    96    97  
   94    95    96    97  
   91  
    0  
   93    98    99   100   101   102   106   110   111   112   116   104  
   98    99   100   106   110   111  
   95    96    97  
   96    97  
   97  
    0  
   99   100   101   102   103   106   110   111   104   105   107  
  100   101   102   110   104  
  101   102   103   106   110   112   116   104   105   107   108   109   120  
  102   103   106   104   105   107  
  103   106   110   111   112   113   114   115   116   117   118   119   104   105   107  
  106   110   112   116   104  
  105   107   108   109   120   121   122   123   106  
  107   108   109   120  
  110   111   112   113   114   115   116   117   118   119  
  108   109   120   121   122   123   124   125   126  
  109   120   121   122   123  
  120   121   122   123  
  111   112   113   114   115   116   117   118   119  
  112   116  
  113   114   115   116   117   118   119  
  114   115   116  
  115   116  
  116  
  117   118   119  
  118   119  
  119  
    0  
  121   122   123   124   125   126  
  122   123   124   125   126  
  123   124   125   126  
  124   125   126  
  125   126  
  126  
    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   0.432500   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  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   38   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   39   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   40   3.5500   0.0760   0.976300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5500   0.0760  -1.202400   2.0020   1.7750   0.023028004  -0.852763146
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   49   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   50   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   57   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   71   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   72   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   73   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   74   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   75   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   76   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   77   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   78   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   79   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   80   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   81   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   82   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   83   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   84   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   88   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   91   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   92   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   93   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   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   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   99   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  100   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
  102   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  103   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  104   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  105   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  106   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
  107   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  108   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
  111   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
  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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  117   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  118   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  119   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  120   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  121   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  122   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  123   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  124   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  125   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  126   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    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    56   268.000  1.529
   33    38   320.000  1.410
   37    40   465.000  1.376
   37    42   320.000  1.462
   40    41   745.000  1.250
   40    44   465.000  1.376
   44    48   465.000  1.376
   44    50   317.000  1.510
   48    49   745.000  1.250
   48    56   270.000  1.512
   56    62   268.000  1.529
   56    66   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    57   317.000  1.510
   57    70   469.000  1.400
   57    83   469.000  1.400
   70    71   469.000  1.400
   70    72   450.000  1.364
   71    74   469.000  1.400
   71    75   310.000  1.470
   74    77   469.000  1.400
   74    78   450.000  1.364
   77    83   469.000  1.400
   77    84   317.000  1.510
   83    90   450.000  1.364
   90    91   553.000  0.945
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    92   268.000  1.529
   92    93   340.000  1.090
   92    98   317.000  1.522
   92   110   317.000  1.522
   98    99   570.000  1.229
   98   100   317.000  1.522
  100   101   340.000  1.090
  100   102   317.000  1.522
  100   104   317.000  1.522
  102   103   570.000  1.229
  102   106   317.000  1.522
  106   110   317.000  1.522
  106   112   268.000  1.529
  106   116   268.000  1.529
  110   111   570.000  1.229
  112   113   340.000  1.090
  112   114   340.000  1.090
  112   115   340.000  1.090
  116   117   340.000  1.090
  116   118   340.000  1.090
  116   119   340.000  1.090
  104   105   570.000  1.229
  104   107   317.000  1.522
  107   108   340.000  1.090
  107   109   340.000  1.090
  107   120   268.000  1.529
  120   121   340.000  1.090
  120   122   340.000  1.090
  120   123   268.000  1.529
  123   124   340.000  1.090
  123   125   340.000  1.090
  123   126   340.000  1.090
   78    79   553.000  0.945
   75    76   570.000  1.229
   75    80   317.000  1.522
   80    81   340.000  1.090
   80    82   340.000  1.090
   80    87   268.000  1.529
   87    88   340.000  1.090
   87    89   340.000  1.090
   87    94   268.000  1.529
   94    95   340.000  1.090
   94    96   340.000  1.090
   94    97   340.000  1.090
   72    73   553.000  0.945
   42    43   570.000  1.229
   42    45   317.000  1.522
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    53   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    58   268.000  1.529
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   38    39   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    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    56    75.00000  111.63000
   29    33    38    85.00000  114.68000
   33    37    40    70.00000  124.00000
   33    37    42    65.00000  116.34900
   33    56    48    70.00000  112.02700
   33    56    62    58.35000  112.70000
   33    56    66    58.35000  112.70000
   33    38    39    55.00000  108.50000
   37    40    41    65.00000  137.10300
   37    40    44    70.00000  123.01800
   37    42    43    80.00000  123.72100
   37    42    45    65.00000  118.62400
   40    44    48    70.00000  117.34000
   40    44    50    70.00000  124.00000
   44    40    41    65.00000  137.10300
   44    48    49    65.00000  137.10300
   44    48    56    65.00000  122.18000
   44    50    51    35.00000  109.50000
   44    50    52    35.00000  109.50000
   44    50    57    70.00000  112.99600
   48    56    62    70.00000  112.02700
   48    56    66    70.00000  112.02700
   56    33    37    70.00000  112.02700
   56    48    49    85.00000  112.85300
   56    62    63    37.50000  110.70000
   56    62    64    37.50000  110.70000
   56    62    65    37.50000  110.70000
   56    66    67    37.50000  110.70000
   56    66    68    37.50000  110.70000
   56    66    69    37.50000  110.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   66    56    62    58.35000  112.70000
   68    66    67    33.00000  107.80000
   69    66    67    33.00000  107.80000
   69    66    68    33.00000  107.80000
   50    44    48    70.00000  124.00000
   50    57    70    70.00000  120.00000
   50    57    83    70.00000  120.00000
   52    50    51    33.00000  107.80000
   57    50    51    35.00000  109.50000
   57    50    52    35.00000  109.50000
   57    70    71    63.00000  120.00000
   57    70    72    70.00000  120.00000
   57    83    77    63.00000  120.00000
   57    83    90    70.00000  120.00000
   70    71    74    63.00000  120.00000
   70    71    75    60.00000  119.52600
   70    72    73    35.00000  113.00000
   71    74    77    63.00000  120.00000
   71    74    78    70.00000  120.00000
   71    75    76    75.00000  123.78400
   71    75    80    65.00000  115.47100
   74    77    83    63.00000  120.00000
   74    77    84    70.00000  120.00000
   74    78    79    35.00000  113.00000
   77    83    90    70.00000  120.00000
   77    84    85    35.00000  109.50000
   77    84    86    35.00000  109.50000
   77    84    92    70.00000  112.17500
   83    57    70    63.00000  120.00000
   83    90    91    35.00000  113.00000
   84    77    83    70.00000  120.00000
   84    92    93    37.50000  110.70000
   84    92    98    63.00000  111.10000
   84    92   110    63.00000  111.10000
   86    84    85    33.00000  107.80000
   92    84    85    37.50000  110.70000
   92    84    86    37.50000  110.70000
   92    98    99    80.00000  120.40000
   92    98   100    70.00000  116.00000
   92   110   106    70.00000  116.00000
   92   110   111    80.00000  120.40000
   98    92    93    35.00000  109.50000
   98   100   101    35.00000  109.50000
   98   100   102    75.00000  107.99600
   98   100   104    75.00000  107.99600
  100    98    99    80.00000  120.40000
  100   102   103    80.00000  120.40000
  100   102   106    70.00000  116.00000
  100   104   105    80.00000  120.40000
  100   104   107    70.00000  116.00000
  102   100   101    35.00000  109.50000
  102   106   110    75.00000  107.99600
  102   106   112    63.00000  111.10000
  102   106   116    63.00000  111.10000
  106   102   103    80.00000  120.40000
  106   110   111    80.00000  120.40000
  106   112   113    37.50000  110.70000
  106   112   114    37.50000  110.70000
  106   112   115    37.50000  110.70000
  106   116   117    37.50000  110.70000
  106   116   118    37.50000  110.70000
  106   116   119    37.50000  110.70000
  110    92    93    35.00000  109.50000
  110    92    98    75.00000  107.99600
  112   106   110    63.00000  111.10000
  114   112   113    33.00000  107.80000
  115   112   113    33.00000  107.80000
  115   112   114    33.00000  107.80000
  116   106   110    63.00000  111.10000
  116   106   112    58.35000  112.70000
  118   116   117    33.00000  107.80000
  119   116   117    33.00000  107.80000
  119   116   118    33.00000  107.80000
  104   100   101    35.00000  109.50000
  104   100   102    75.00000  107.99600
  104   107   108    35.00000  109.50000
  104   107   109    35.00000  109.50000
  104   107   120    63.00000  111.10000
  107   104   105    80.00000  120.40000
  107   120   121    37.50000  110.70000
  107   120   122    37.50000  110.70000
  107   120   123    58.35000  112.70000
  109   107   108    33.00000  107.80000
  120   107   108    37.50000  110.70000
  120   107   109    37.50000  110.70000
  120   123   124    37.50000  110.70000
  120   123   125    37.50000  110.70000
  120   123   126    37.50000  110.70000
  122   120   121    33.00000  107.80000
  123   120   121    37.50000  110.70000
  123   120   122    37.50000  110.70000
  125   123   124    33.00000  107.80000
  126   123   124    33.00000  107.80000
  126   123   125    33.00000  107.80000
   78    74    77    70.00000  120.00000
   75    71    74    60.00000  119.52600
   75    80    81    35.00000  109.50000
   75    80    82    35.00000  109.50000
   75    80    87    63.00000  111.10000
   80    75    76    80.00000  120.40000
   80    87    88    37.50000  110.70000
   80    87    89    37.50000  110.70000
   80    87    94    58.35000  112.70000
   82    80    81    33.00000  107.80000
   87    80    81    37.50000  110.70000
   87    80    82    37.50000  110.70000
   87    94    95    37.50000  110.70000
   87    94    96    37.50000  110.70000
   87    94    97    37.50000  110.70000
   89    87    88    33.00000  107.80000
   94    87    88    37.50000  110.70000
   94    87    89    37.50000  110.70000
   96    94    95    33.00000  107.80000
   97    94    95    33.00000  107.80000
   97    94    96    33.00000  107.80000
   72    70    71    70.00000  120.00000
   42    37    40    60.00000  125.92000
   42    45    46    35.00000  109.50000
   42    45    47    35.00000  109.50000
   42    45    53    63.00000  111.10000
   45    42    43    80.00000  120.40000
   45    53    54    37.50000  110.70000
   45    53    55    37.50000  110.70000
   45    53    58    58.35000  112.70000
   47    45    46    33.00000  107.80000
   53    45    46    37.50000  110.70000
   53    45    47    37.50000  110.70000
   53    58    59    37.50000  110.70000
   53    58    60    37.50000  110.70000
   53    58    61    37.50000  110.70000
   55    53    54    33.00000  107.80000
   58    53    54    37.50000  110.70000
   58    53    55    37.50000  110.70000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   38    33    37    90.00000  110.39200
   38    33    56    50.00000  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    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    56   0.01700  1.0 1.0
   24    29    33    56  -0.23550 -1.0 2.0
   24    29    33    56   0.21350  1.0 3.0
   24    29    33    38   0.13850  1.0 1.0
   24    29    33    38  -1.34450 -1.0 2.0
   24    29    33    38   0.57400  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    40   0.42700  1.0 1.0
   29    33    37    40  -0.70350 -1.0 2.0
   29    33    37    40  -0.43150  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    56    48   0.56750  1.0 1.0
   29    33    56    48  -0.07550 -1.0 2.0
   29    33    56    48   0.20000  1.0 3.0
   29    33    56    62   0.44750  1.0 1.0
   29    33    56    62  -0.17800 -1.0 2.0
   29    33    56    62   0.20200  1.0 3.0
   29    33    56    66   0.44750  1.0 1.0
   29    33    56    66  -0.17800 -1.0 2.0
   29    33    56    66   0.20200  1.0 3.0
   29    33    38    39   0.35600  1.0 1.0
   29    33    38    39  -0.10750 -1.0 2.0
   29    33    38    39  -0.54400  1.0 3.0
   33    37    40    41   7.00000 -1.0 2.0
   33    37    40    44   7.00000 -1.0 2.0
   33    37    42    43  -0.64400  1.0 1.0
   33    37    42    43   0.26850 -1.0 2.0
   33    37    42    45   0.25700  1.0 1.0
   33    37    42    45   0.66200 -1.0 2.0
   33    37    42    45   0.04450  1.0 3.0
   33    56    62    63   0.15000  1.0 3.0
   33    56    62    64   0.15000  1.0 3.0
   33    56    62    65   0.15000  1.0 3.0
   33    56    66    67   0.15000  1.0 3.0
   33    56    66    68   0.15000  1.0 3.0
   33    56    66    69   0.15000  1.0 3.0
   37    33    56    48   0.31000  1.0 1.0
   37    33    56    48   0.14700 -1.0 2.0
   37    33    56    48   0.07550  1.0 3.0
   37    33    56    62   0.34400  1.0 1.0
   37    33    56    62   0.09450 -1.0 2.0
   37    33    56    62   0.11100  1.0 3.0
   37    33    56    66   0.34400  1.0 1.0
   37    33    56    66   0.09450 -1.0 2.0
   37    33    56    66   0.11100  1.0 3.0
   37    33    38    39  -0.07800  1.0 1.0
   37    33    38    39  -0.21500 -1.0 2.0
   37    33    38    39  -0.03150  1.0 3.0
   37    40   -44    48   7.00000 -1.0 2.0
   37    40    44    50   7.00000 -1.0 2.0
   37    42    45    46   0.00000  1.0 1.0
   37    42    45    47   0.00000  1.0 1.0
   37    42    45    53   0.65300  1.0 1.0
   37    42    45    53  -0.03850 -1.0 2.0
   37    42    45    53   0.33900  1.0 3.0
   40    37    42    43   1.00000 -1.0 2.0
   40    37    42    45  -0.33500  1.0 1.0
   40    37    42    45   1.06600 -1.0 2.0
   40    37    42    45  -0.14000  1.0 3.0
   40    44    48    49   7.00000 -1.0 2.0
   40    44    48    56   7.00000 -1.0 2.0
   40    44    50    51   0.00000  1.0 1.0
   40    44    50    52   0.00000  1.0 1.0
   40    44    50    57   1.44450  1.0 1.0
   40    44    50    57   0.06600 -1.0 2.0
   40    44    50    57   0.29250  1.0 3.0
   41    40    44    48   7.00000 -1.0 2.0
   41    40    44    50   7.00000 -1.0 2.0
   44    48   -56    33   0.09850  1.0 1.0
   44    48   -56    33   0.15250 -1.0 2.0
   44    48   -56    33  -0.50650  1.0 3.0
   44    48    56    62   0.09850  1.0 1.0
   44    48    56    62   0.15250 -1.0 2.0
   44    48    56    62  -0.50650  1.0 3.0
   44    48    56    66   0.09850  1.0 1.0
   44    48    56    66   0.15250 -1.0 2.0
   44    48    56    66  -0.50650  1.0 3.0
   44    50    57    70   0.18050 -1.0 2.0
   44    50    57    83   0.18050 -1.0 2.0
   48    44    50    51   0.00000  1.0 1.0
   48    44    50    52   0.00000  1.0 1.0
   48    44    50    57   1.44450  1.0 1.0
   48    44    50    57   0.06600 -1.0 2.0
   48    44    50    57   0.29250  1.0 3.0
   48    56    62    63   0.15000  1.0 3.0
   48    56    62    64   0.15000  1.0 3.0
   48    56    62    65   0.15000  1.0 3.0
   48    56    66    67   0.15000  1.0 3.0
   48    56    66    68   0.15000  1.0 3.0
   48    56    66    69   0.15000  1.0 3.0
   49    48    56    33   0.09700  1.0 1.0
   49    48    56    33   0.15600 -1.0 2.0
   49    48    56    33  -0.50800  1.0 3.0
   49    48    56    62   0.09700  1.0 1.0
   49    48    56    62   0.15600 -1.0 2.0
   49    48    56    62  -0.50800  1.0 3.0
   49    48    56    66   0.09700  1.0 1.0
   49    48    56    66   0.15600 -1.0 2.0
   49    48    56    66  -0.50800  1.0 3.0
   56    33   -37    40   0.09850  1.0 1.0
   56    33   -37    40   0.15250 -1.0 2.0
   56    33   -37    40  -0.50650  1.0 3.0
   56    33    37    42   0.09700  1.0 1.0
   56    33    37    42   0.15600 -1.0 2.0
   56    33    37    42  -0.50800  1.0 3.0
   56    33    38    39  -0.11600  1.0 1.0
   56    33    38    39  -0.09450 -1.0 2.0
   56    33    38    39   0.21250  1.0 3.0
   62    56    66    67   0.15000  1.0 3.0
   62    56    66    68   0.15000  1.0 3.0
   62    56    66    69   0.15000  1.0 3.0
   66    56    62    63   0.15000  1.0 3.0
   66    56    62    64   0.15000  1.0 3.0
   66    56    62    65   0.15000  1.0 3.0
   50    44    48    49   7.00000 -1.0 2.0
   50    44    48    56   7.00000 -1.0 2.0
   50    57    70    71   3.62500 -1.0 2.0
   50    57    70    72   3.62500 -1.0 2.0
   50    57    83    77   3.62500 -1.0 2.0
   50    57    83    90   3.62500 -1.0 2.0
   51    50    57    70   0.00000  1.0 1.0
   51    50    57    83   0.00000  1.0 1.0
   52    50    57    70   0.00000  1.0 1.0
   52    50    57    83   0.00000  1.0 1.0
   57    70    71    74   3.62500 -1.0 2.0
   57    70    71    75   3.62500 -1.0 2.0
   57    70    72    73   0.84100 -1.0 2.0
   57    83    90    91   0.84100 -1.0 2.0
   70    57    83    77   3.62500 -1.0 2.0
   70    57    83    90   3.62500 -1.0 2.0
   70    71   -74    77   3.62500 -1.0 2.0
   70    71    74    78   3.62500 -1.0 2.0
   70    71    75    76   1.05000 -1.0 2.0
   70    71    75    80   2.26350  1.0 1.0
   70    71    75    80   0.76750 -1.0 2.0
   70    71    75    80   0.22500  1.0 3.0
   71    70    72    73   0.84100 -1.0 2.0
   71    74    77    83   3.62500 -1.0 2.0
   71    74    77    84   3.62500 -1.0 2.0
   71    74    78    79   0.84100 -1.0 2.0
   71    75    80    81   0.00000  1.0 1.0
   71    75    80    82   0.00000  1.0 1.0
   71    75    80    87   0.05850 -1.0 2.0
   71    75    80    87   0.17250  1.0 3.0
   74    71    75    76   1.05000 -1.0 2.0
   74    71    75    80   2.26350  1.0 1.0
   74    71    75    80   0.76750 -1.0 2.0
   74    71    75    80   0.22500  1.0 3.0
   74    77   -83    57   3.62500 -1.0 2.0
   74    77    83    90   3.62500 -1.0 2.0
   74    77    84    85   0.00000  1.0 1.0
   74    77    84    86   0.00000  1.0 1.0
   74    77    84    92   0.04150 -1.0 2.0
   77    74    78    79   0.84100 -1.0 2.0
   77    83    90    91   0.84100 -1.0 2.0
   77    84    92    93   0.43200  1.0 3.0
   77    84    92    98   0.56750  1.0 1.0
   77    84    92    98  -0.07550 -1.0 2.0
   77    84    92    98   0.20000  1.0 3.0
   77    84    92   110   0.56750  1.0 1.0
   77    84    92   110  -0.07550 -1.0 2.0
   77    84    92   110   0.20000  1.0 3.0
   83    57   -70    71   3.62500 -1.0 2.0
   83    57    70    72   3.62500 -1.0 2.0
   83    77    84    85   0.00000  1.0 1.0
   83    77    84    86   0.00000  1.0 1.0
   83    77    84    92   0.04150 -1.0 2.0
   84    77    83    57   3.62500 -1.0 2.0
   84    77    83    90   3.62500 -1.0 2.0
   84    92    98    99   0.30150 -1.0 2.0
   84    92    98   100   0.60050  1.0 1.0
   84    92    98   100   0.05600 -1.0 2.0
   84    92    98   100   0.26150  1.0 3.0
   84    92   110   106   0.60050  1.0 1.0
   84    92   110   106   0.05600 -1.0 2.0
   84    92   110   106   0.26150  1.0 3.0
   84    92   110   111   0.30150 -1.0 2.0
   85    84    92    93   0.15000  1.0 3.0
   85    84    92    98  -0.11250  1.0 3.0
   85    84    92   110  -0.11250  1.0 3.0
   86    84    92    93   0.15000  1.0 3.0
   86    84    92    98  -0.11250  1.0 3.0
   86    84    92   110  -0.11250  1.0 3.0
   92    98   100   101   0.00000  1.0 1.0
   92    98   100   102   0.65300  1.0 1.0
   92    98   100   102  -0.03850 -1.0 2.0
   92    98   100   102   0.33900  1.0 3.0
   92    98   100   104   0.65300  1.0 1.0
   92    98   100   104  -0.03850 -1.0 2.0
   92    98   100   104   0.33900  1.0 3.0
   93    92    98    99   0.00000  1.0 1.0
   93    92    98   100   0.00000  1.0 1.0
   93    92   110   106   0.00000  1.0 1.0
   93    92   110   111   0.00000  1.0 1.0
   98    92   110   106   0.65300  1.0 1.0
   98    92   110   106  -0.03850 -1.0 2.0
   98    92   110   106   0.33900  1.0 3.0
   98    92   110   111   0.30150 -1.0 2.0
   98   100   102   103   0.30150 -1.0 2.0
   98   100  -102   106   0.65300  1.0 1.0
   98   100  -102   106  -0.03850 -1.0 2.0
   98   100  -102   106   0.33900  1.0 3.0
   98   100   104   105   0.30150 -1.0 2.0
   98   100   104   107   0.65300  1.0 1.0
   98   100   104   107  -0.03850 -1.0 2.0
   98   100   104   107   0.33900  1.0 3.0
   99    98   100   101   0.00000  1.0 1.0
   99    98   100   102   0.30150 -1.0 2.0
   99    98   100   104   0.30150 -1.0 2.0
  100   102   106   110   0.65300  1.0 1.0
  100   102   106   110  -0.03850 -1.0 2.0
  100   102   106   110   0.33900  1.0 3.0
  100   102   106   112   0.60050  1.0 1.0
  100   102   106   112   0.05600 -1.0 2.0
  100   102   106   112   0.26150  1.0 3.0
  100   102   106   116   0.60050  1.0 1.0
  100   102   106   116   0.05600 -1.0 2.0
  100   102   106   116   0.26150  1.0 3.0
  100   104   107   108   0.00000  1.0 1.0
  100   104   107   109   0.00000  1.0 1.0
  100   104   107   120   0.60050  1.0 1.0
  100   104   107   120   0.05600 -1.0 2.0
  100   104   107   120   0.26150  1.0 3.0
  101   100   102   103   0.00000  1.0 1.0
  101   100   102   106   0.00000  1.0 1.0
  101   100   104   105   0.00000  1.0 1.0
  101   100   104   107   0.00000  1.0 1.0
  102   100   104   105   0.30150 -1.0 2.0
  102   100   104   107   0.65300  1.0 1.0
  102   100   104   107  -0.03850 -1.0 2.0
  102   100   104   107   0.33900  1.0 3.0
  102   106  -110    92   0.65300  1.0 1.0
  102   106  -110    92  -0.03850 -1.0 2.0
  102   106  -110    92   0.33900  1.0 3.0
  102   106   110   111   0.30150 -1.0 2.0
  102   106   112   113  -0.11250  1.0 3.0
  102   106   112   114  -0.11250  1.0 3.0
  102   106   112   115  -0.11250  1.0 3.0
  102   106   116   117  -0.11250  1.0 3.0
  102   106   116   118  -0.11250  1.0 3.0
  102   106   116   119  -0.11250  1.0 3.0
  103   102   106   110   0.30150 -1.0 2.0
  103   102   106   112   0.30150 -1.0 2.0
  103   102   106   116   0.30150 -1.0 2.0
  110    92    98    99   0.30150 -1.0 2.0
  110    92   -98   100   0.65300  1.0 1.0
  110    92   -98   100  -0.03850 -1.0 2.0
  110    92   -98   100   0.33900  1.0 3.0
  110   106   112   113  -0.11250  1.0 3.0
  110   106   112   114  -0.11250  1.0 3.0
  110   106   112   115  -0.11250  1.0 3.0
  110   106   116   117  -0.11250  1.0 3.0
  110   106   116   118  -0.11250  1.0 3.0
  110   106   116   119  -0.11250  1.0 3.0
  112   106   110    92   0.60050  1.0 1.0
  112   106   110    92   0.05600 -1.0 2.0
  112   106   110    92   0.26150  1.0 3.0
  112   106   110   111   0.30150 -1.0 2.0
  112   106   116   117   0.15000  1.0 3.0
  112   106   116   118   0.15000  1.0 3.0
  112   106   116   119   0.15000  1.0 3.0
  116   106   110    92   0.60050  1.0 1.0
  116   106   110    92   0.05600 -1.0 2.0
  116   106   110    92   0.26150  1.0 3.0
  116   106   110   111   0.30150 -1.0 2.0
  116   106   112   113   0.15000  1.0 3.0
  116   106   112   114   0.15000  1.0 3.0
  116   106   112   115   0.15000  1.0 3.0
  104   100   102   103   0.30150 -1.0 2.0
  104   100   102   106   0.65300  1.0 1.0
  104   100   102   106  -0.03850 -1.0 2.0
  104   100   102   106   0.33900  1.0 3.0
  104   107   120   121  -0.11250  1.0 3.0
  104   107   120   122  -0.11250  1.0 3.0
  104   107   120   123  -0.95700  1.0 1.0
  104   107   120   123  -0.18200 -1.0 2.0
  104   107   120   123   0.29450  1.0 3.0
  105   104   107   108   0.00000  1.0 1.0
  105   104   107   109   0.00000  1.0 1.0
  105   104   107   120   0.30150 -1.0 2.0
  107   120   123   124   0.15000  1.0 3.0
  107   120   123   125   0.15000  1.0 3.0
  107   120   123   126   0.15000  1.0 3.0
  108   107   120   121   0.15000  1.0 3.0
  108   107   120   122   0.15000  1.0 3.0
  108   107   120   123   0.15000  1.0 3.0
  109   107   120   121   0.15000  1.0 3.0
  109   107   120   122   0.15000  1.0 3.0
  109   107   120   123   0.15000  1.0 3.0
  121   120   123   124   0.15000  1.0 3.0
  121   120   123   125   0.15000  1.0 3.0
  121   120   123   126   0.15000  1.0 3.0
  122   120   123   124   0.15000  1.0 3.0
  122   120   123   125   0.15000  1.0 3.0
  122   120   123   126   0.15000  1.0 3.0
   78    74    77    83   3.62500 -1.0 2.0
   78    74    77    84   3.62500 -1.0 2.0
   75    71    74    77   3.62500 -1.0 2.0
   75    71    74    78   3.62500 -1.0 2.0
   75    80    87    88  -0.11250  1.0 3.0
   75    80    87    89  -0.11250  1.0 3.0
   75    80    87    94  -0.95700  1.0 1.0
   75    80    87    94  -0.18200 -1.0 2.0
   75    80    87    94   0.29450  1.0 3.0
   76    75    80    81   0.00000  1.0 1.0
   76    75    80    82   0.00000  1.0 1.0
   76    75    80    87   0.30150 -1.0 2.0
   80    87    94    95   0.15000  1.0 3.0
   80    87    94    96   0.15000  1.0 3.0
   80    87    94    97   0.15000  1.0 3.0
   81    80    87    88   0.15000  1.0 3.0
   81    80    87    89   0.15000  1.0 3.0
   81    80    87    94   0.15000  1.0 3.0
   82    80    87    88   0.15000  1.0 3.0
   82    80    87    89   0.15000  1.0 3.0
   82    80    87    94   0.15000  1.0 3.0
   88    87    94    95   0.15000  1.0 3.0
   88    87    94    96   0.15000  1.0 3.0
   88    87    94    97   0.15000  1.0 3.0
   89    87    94    95   0.15000  1.0 3.0
   89    87    94    96   0.15000  1.0 3.0
   89    87    94    97   0.15000  1.0 3.0
   72    70    71    74   3.62500 -1.0 2.0
   72    70    71    75   3.62500 -1.0 2.0
   42    37    40    41   7.00000 -1.0 2.0
   42    37    40    44   7.00000 -1.0 2.0
   42    45    53    54  -0.11250  1.0 3.0
   42    45    53    55  -0.11250  1.0 3.0
   42    45    53    58  -0.95700  1.0 1.0
   42    45    53    58  -0.18200 -1.0 2.0
   42    45    53    58   0.29450  1.0 3.0
   43    42    45    46   0.00000  1.0 1.0
   43    42    45    47   0.00000  1.0 1.0
   43    42    45    53   0.30150 -1.0 2.0
   45    53    58    59   0.15000  1.0 3.0
   45    53    58    60   0.15000  1.0 3.0
   45    53    58    61   0.15000  1.0 3.0
   46    45    53    54   0.15000  1.0 3.0
   46    45    53    55   0.15000  1.0 3.0
   46    45    53    58   0.15000  1.0 3.0
   47    45    53    54   0.15000  1.0 3.0
   47    45    53    55   0.15000  1.0 3.0
   47    45    53    58   0.15000  1.0 3.0
   54    53    58    59   0.15000  1.0 3.0
   54    53    58    60   0.15000  1.0 3.0
   54    53    58    61   0.15000  1.0 3.0
   55    53    58    59   0.15000  1.0 3.0
   55    53    58    60   0.15000  1.0 3.0
   55    53    58    61   0.15000  1.0 3.0
   38    33    37    40   0.67800  1.0 1.0
   38    33    37    40   0.47050 -1.0 2.0
   38    33    37    40  -0.62500  1.0 3.0
   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    56    48   1.05650  1.0 1.0
   38    33    56    48   0.15600 -1.0 2.0
   38    33    56    48   0.53150  1.0 3.0
   38    33    56    62   0.86500  1.0 1.0
   38    33    56    62  -0.17500 -1.0 2.0
   38    33    56    62   0.20800  1.0 3.0
   38    33    56    66   0.86500  1.0 1.0
   38    33    56    66  -0.17500 -1.0 2.0
   38    33    56    66   0.20800  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    40   1.10000 -1.0 2.0
   44    41    40    37   1.10000 -1.0 2.0
   40    50    44    48   1.10000 -1.0 2.0
   56    49    48    44   1.10000 -1.0 2.0
   70    83    57    50   4.00000 -1.0 2.0
   71    72    70    57   4.00000 -1.0 2.0
   74    75    71    70   4.00000 -1.0 2.0
   77    78    74    71   4.00000 -1.0 2.0
   83    84    77    74   4.00000 -1.0 2.0
   77    90    83    57   4.00000 -1.0 2.0
   92   100    98    99  10.50000 -1.0 2.0
  100   106   102   103  10.50000 -1.0 2.0
   92   106   110   111  10.50000 -1.0 2.0
  100   107   104   105  10.50000 -1.0 2.0
   71    80    75    76  10.50000 -1.0 2.0
   37    45    42    43  10.50000 -1.0 2.0
END
