* LIGAND DATABASE FILE (OPLS2005)
*
001     107   111    201    320     596
    1     0 S   NP   _N1_     1    29.00647    95.55269   -26.13538
    2     1 S   H    _HN1     2     1.02777   116.93238  -124.84726
    3     1 S   H    _H1_     3     1.02956    88.29469   -15.10856
    4     1 S   H    _H2_     4     1.02835    18.85943   170.09113
    5     1 S   CT   _CA1     5     1.50144   117.56778    97.08561
    6     5 S   HC   _HA1     6     1.09576   105.20037    78.55947
    7     5 S   CO3  _C1_     7     1.53778   112.27427   -41.59659
    8     7 S   O2Z  _O11     8     1.26368   114.99937   -45.41351
    9     7 S   O2Z  _O12     9     1.26227   114.92279   133.52037
   10     5 S   CT   _CB1    10     1.53077   107.39820  -163.58044
   11    10 S   HC   HB11    11     1.09831   109.31113   -50.39452
   12    10 S   HC   HB12    12     1.09815   110.44905    66.14625
   13    10 S   CT   _CG1    13     1.53031   112.69178  -171.44134
   14    13 S   HC   HG11    14     1.09593   110.52262   -64.78512
   15    13 S   HC   HG12    15     1.09657   109.90708    54.43846
   16    13 S   C    _CD1    16     1.51846   112.20811   174.78507
   17    16 S   O    _OE1    17     1.22770   123.24735     1.86876
   18    16 S   N    _N2_    18     1.38541   111.79054  -178.08113
   19    18 S   H    _HN2    19     1.01568   119.24519     3.51034
   20    18 S   CT1  _CA2    20     1.45882   122.79485   178.32019
   21    20 S   HC   _HA2    21     1.09676   108.82706    26.93618
   22    20 S   C    _C2_    22     1.53073   106.37600   -90.42822
   23    22 S   O    _O2_    23     1.23059   122.75586   -27.36505
   24    20 S   CT   _CB2    32     1.53232   112.66445   150.08986
   25    24 S   HC   HB21    33     1.09618   110.28017    63.66054
   26    24 S   HC   HB22    34     1.09492   109.73514  -177.94672
   27    22 S   N    _N3_    24     1.38565   113.03643   155.45566
   28    27 S   H    _HN3    25     1.01669   119.61985    -6.18028
   29    24 S   S    _SG2    35     1.82463   112.11890   -56.57484
   30    27 S   CT   _CA3    26     1.45574   122.08578   179.20870
   31    30 S   HC   HA31    27     1.09575   108.77038   -36.41722
   32    30 S   HC   HA32    28     1.09560   107.25749    79.61583
   33    29 S   CT   _C20    36     1.83246    98.92853  -170.56212
   34    33 S   HC   _H3_    37     1.09573   106.97306   -34.05044
   35    30 S   CO3  _C3_    29     1.52632   113.42680  -159.99883
   36    35 S   O2Z  _O31    30     1.26420   115.24871   -56.58443
   37    35 S   O2Z  _O32    31     1.26285   115.24631   123.25499
   38    33 S   CM   _C12    38     1.52676   111.86139  -152.12468
   39    38 S   CT   _C19    39     1.53875   114.86690  -104.80877
   40    39 S   HC   _H52    40     1.09742   108.27655   146.67073
   41    38 S   CMA  _C15   101     1.36895   122.56961    78.11311
   42    41 S   OM   _O30   102     1.26973   125.38975    -0.43386
   43    39 S   CT   _C21    41     1.54972   108.55453    31.94140
   44    43 S   HC   _H54    42     1.10088   106.67337    59.86352
   45    39 S   CT   _C29    74     1.55661   109.48029   -94.00032
   46    45 S   HC   _H64    75     1.09664   109.43841    91.19698
   47    45 S   HC   _H65    76     1.10008   109.95182   -23.40165
   48    41 S   OS   _O39   103     1.41912   111.60431   177.39331
   49    43 S   CO   _C26    43     1.54766   111.84770   -57.48129
   50    49 S   HC   _H59    44     1.09739   109.45257   -91.56633
   51    43 S   CM   _C14    69     1.51284   113.60739   176.89562
   52    51 S   HC   _H46    70     1.08707   117.82763    73.08532
   53    45 S   CT   _C18    77     1.54763   115.06300  -145.18553
   54    53 S   HC   _H51    78     1.09427   110.03341   -58.78131
   55    48 S   CT   _C28   104     1.42680   114.06062   140.51886
   56    55 S   HC   _H61   105     1.09406   107.73869  -171.13816
   57    55 S   HC   _H62   106     1.09475   111.03028    70.93313
   58    55 S   HC   _H63   107     1.09537   111.11299   -52.95470
   59    33 S   OS   _O33    45     1.43213   113.88997    80.87930
   60    49 S   OS1  _O40    46     1.43334   107.72952   151.06648
   61    51 S   CM   _C13    71     1.33839   124.00703  -107.94368
   62    61 S   HC   _H44    72     1.08461   120.49847  -179.52687
   63    61 S   HC   _H45    73     1.08460   121.59139     0.59017
   64    53 S   C5A  _C11    79     1.50353   111.50896  -178.13135
   65    60 S   CO1  _C27    47     1.43005   113.91301   160.98240
   66    65 S   HC   _H60    48     1.09806   108.23868   -56.78309
   67    64 S   C5B  _C9_    80     1.38001   125.58319  -136.09833
   68    64 S   NA   _N28    91     1.36715   126.31468    47.28050
   69    68 S   H    _H68    92     1.01058   125.55414    -1.64473
   70    65 S   CT   _C24    49     1.53457   107.69281  -174.84254
   71    70 S   HC   _H57    50     1.09565   110.79788    58.39722
   72    67 S   C56B _C8_    81     1.42039   107.86483  -178.64723
   73    67 S   CT   _C16    93     1.48793   120.98256     1.61737
   74    73 S   HC   _H47    94     1.09675   108.99741   102.92903
   75    73 S   HC   _H48    95     1.09543   110.66738  -138.63853
   76    70 S   CT   _C22    51     1.53064   109.64278  -178.97359
   77    76 S   HC   _H55    52     1.09727   108.39588   -67.49128
   78    70 S   OH5  _O37    67     1.43155   109.16830   -57.99004
   79    78 S   HO   _H72    68     0.97326   107.00575  -163.16940
   80    72 S   CA   _C6_    82     1.40917   134.49353  -179.35532
   81    80 S   HA   _H42    83     1.08615   120.72895     0.20748
   82    73 S   CT   _C17    96     1.54288   109.96369   -17.40550
   83    82 S   HC   _H49    97     1.09560   109.19724   168.41219
   84    82 S   HC   _H50    98     1.09756   110.29345   -74.83624
   85    76 S   CT   _C23    53     1.53458   111.88046    52.25678
   86    85 S   HC   _H56    54     1.09633   109.44311  -173.51502
   87    76 S   OH5  _O35    65     1.42495   109.39990   176.05097
   88    87 S   HO   _H70    66     0.97241   107.69461  -172.12358
   89    80 S   CA   _C4_    84     1.39952   119.27060  -179.81762
   90    89 S   HA   _H40    85     1.08688   119.52425  -179.96044
   91    53 S   NT   _N29    99     1.48554   109.95699    59.83664
   92    91 S   H    _H69   100     1.02100   109.01774    45.46894
   93    85 S   CT   _C25    55     1.53748   109.48418   -51.77050
   94    93 S   HC   _H58    56     1.09805   109.97254   -63.52051
   95    85 S   OH5  _O36    63     1.42671   109.30107    69.61368
   96    95 S   HO   _H71    64     0.97642   107.72548   158.86332
   97    89 S   CA   _C5_    86     1.39327   120.76093     0.06853
   98    97 S   HA   _H41    87     1.08717   119.55537   179.98022
   99    65 S   OS1  _O34    57     1.43035   112.58211    63.86647
  100    93 S   CT   _C30    58     1.52703   112.70113   174.76224
  101   100 S   HC   _H66    59     1.09400   111.17572    47.75825
  102   100 S   HC   _H67    60     1.09345   111.28084   -75.24937
  103    97 S   CA   _C7_    88     1.39785   121.04507     0.00000
  104   103 S   HA   _H43    89     1.08492   120.91914   179.92598
  105   100 S   OH5  _O38    61     1.42574   109.05835   166.47191
  106   105 S   HO   _H73    62     0.97272   106.74485   176.86325
  107    72 S   C56A _C10    90     1.39871   106.76791     0.89809
  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   7   5   4   3
  13   5   2   1   1  15  20   9   9   2  15   8  12   5   4   4
  10   4   6   3  13   6   3   2   1   1   2   8   2   1   1  13
  13   6  15   9   3  12   7  12   9   5   4  13   7   4   1   7
   4   4   3   2  12   7   3   1   6   3   1   1   9   6   3   1
   4   3   4   4   3   2   2   1   1   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    59    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    49    59    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    43    49    50    59    60    45    41    42    48  
   38    39    49    59    41  
   36    37  
   37  
    0  
   39    40    43    44    49    59    51    45    46    47    53    41    42    48    55  
   40    43    44    49    50    59    60    51    52    61    45    46    47    53    54    64    91    41    42    48  
   43    44    49    51    45    46    47    53    41  
   42    48    55    56    57    58    43    45    59  
   48    55  
   44    49    50    59    60    65    51    52    61    62    63    45    46    47    53  
   49    50    59    60    51    52    61    45  
   46    47    53    54    64    67    68    82    91    92    49    51  
   47    53    54    64    91  
   53    54    64    91  
   55    56    57    58  
   50    59    60    65    66    70    99    51    52    61  
   59    60    65    51  
   52    61    62    63    59    60  
   61    62    63  
   54    64    67    72   107    68    69    73    82    83    84    91    92  
   64    67    68    82    91    92  
   56    57    58  
   57    58  
   58  
    0  
   60    65  
   65    66    70    71    76    93    99    78  
   62    63  
   63  
    0  
   67    72    80   103   107    68    69    73    74    75    82    91    92  
   66    70    71    76    77    85    93    94    99   100    87    78    79  
   70    71    76    93    99    78  
   72    80    81    89   103   107    68    69    73    74    75    82    83    84    91  
   69    73    91    72    80    97   103   104   107  
   72   103   107  
   71    76    77    85    86    93    99    95    87    88    78    79  
   76    77    85    99    87    78    79  
   80    81    89    90    97   103   104   107    73    74    75    82  
   74    75    82    83    84    91    92    80   107  
   75    82    83    84    91  
   82    83    84    91  
   77    85    86    93    94    99   100    95    96    87    88    78    79  
   85    86    93    95    87    88    78  
   79    85    87    99  
    0  
   81    89    90    97    98   103   107  
   89    90    97   107  
   83    84    91    92  
   84    91    92  
   91    92  
   86    93    94    99   100   101   102   105    95    96    87    88  
   93    94    99   100    95    96    87  
   88    93    95  
    0  
   90    97    98   103   104   107  
   97    98   103  
   92  
    0  
   94    99   100   101   102   105   106    95    96  
   99   100   101   102   105    95  
   96    99   100  
    0  
   98   103   104   107  
  103   104   107  
  100   101   102   105  
  101   102   105   106  
  102   105   106  
  105   106  
  104   107  
  107  
  106  
    0  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.316400   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   0.387900   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0760  -0.670200   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   42   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   43   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.8500   0.1400  -0.685000   1.5900   1.4000   0.020110767  -0.896042159
   49   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660   0.255000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   59   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   60   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   61   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   62   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   63   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0700  -0.029300   2.5000   1.7750   0.001000000  -0.843144165
   65   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   67   3.5500   0.0700  -0.174900   2.5000   1.7750   0.001000000  -0.843144165
   68   3.2500   0.1700  -0.478600   1.8650   1.6500   0.001000000  -0.511443539
   69   0.5000   0.0300   0.357700   0.9960   0.8600   0.030040813  -0.651083722
   70   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   3.5500   0.0700   0.123300   2.5000   1.7750   0.001000000  -0.843144165
   73   3.5000   0.0660  -0.064100   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   77   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   78   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   79   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   80   3.5500   0.0700  -0.224300   2.0020   1.7750   0.001000000  -0.843144165
   81   2.4200   0.0300   0.169900   1.3810   1.2100   0.030040813   0.268726247
   82   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660   0.205000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   88   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   89   3.5500   0.0700  -0.222200   2.0020   1.7750   0.001000000  -0.843144165
   90   2.4200   0.0300   0.148900   1.3810   1.2100   0.030040813   0.268726247
   91   3.3000   0.1700  -0.780000   1.8650   1.6500   0.051222218  -2.220205820
   92   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   93   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   95   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   96   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   97   3.5500   0.0700  -0.088800   2.0020   1.7750   0.001000000  -0.843144165
   98   2.4200   0.0300   0.135900   1.3810   1.2100   0.030040813   0.268726247
   99   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
  100   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5500   0.0700  -0.354100   2.5000   1.7750   0.001000000  -0.843144165
  104   2.4200   0.0300   0.179600   1.3810   1.2100   0.030040813   0.268726247
  105   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
  106   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
  107   3.5500   0.0700   0.286000   2.5000   1.7750   0.001000000  -0.843144165
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    59   320.000  1.410
   38    39   317.000  1.510
   38    41   465.000  1.376
   39    40   340.000  1.090
   39    43   268.000  1.529
   39    45   268.000  1.529
   43    44   340.000  1.090
   43    49   250.000  1.527
   43    51   317.000  1.510
   49    50   340.000  1.090
   49    59   320.000  1.380
   49    60   320.000  1.380
   60    65   370.000  1.399
   65    66   360.000  1.097
   65    70   255.000  1.525
   65    99   370.000  1.399
   70    71   340.000  1.090
   70    76   268.000  1.529
   70    78   355.000  1.421
   76    77   340.000  1.090
   76    85   268.000  1.529
   76    87   355.000  1.421
   85    86   340.000  1.090
   85    93   268.000  1.529
   85    95   355.000  1.421
   93    94   340.000  1.090
   93    99   335.000  1.422
   93   100   268.000  1.529
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   105   355.000  1.421
  105   106   580.000  0.967
   95    96   580.000  0.967
   87    88   580.000  0.967
   78    79   580.000  0.967
   51    52   340.000  1.080
   51    61   549.000  1.340
   61    62   340.000  1.080
   61    63   340.000  1.080
   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    64   295.000  1.489
   53    91   382.000  1.448
   64    67   520.000  1.370
   64    68   427.000  1.381
   67    72   380.000  1.440
   67    73   295.000  1.494
   72    80   469.000  1.404
   72   107   447.000  1.419
   80    81   367.000  1.080
   80    89   469.000  1.400
   89    90   367.000  1.080
   89    97   469.000  1.400
   97    98   367.000  1.080
   97   103   469.000  1.400
  103   104   367.000  1.080
  103   107   469.000  1.400
  107    68   428.000  1.380
   68    69   434.000  1.010
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    82   268.000  1.529
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    91   382.000  1.448
   91    92   434.000  1.010
   41    42   745.000  1.250
   41    48   440.000  1.360
   48    55   320.000  1.410
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    59    85.00000  114.68000
   33    38    39    65.00000  117.92700
   33    38    41    70.00000  124.00000
   33    59    49    60.00000  109.50000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  109.50000
   38    39    43    70.00000  112.02700
   38    39    45    70.00000  112.02700
   38    41    42    65.00000  137.10300
   38    41    48    80.00000  120.01400
   39    43    44    37.50000  110.70000
   39    43    49    75.00000  109.43000
   39    43    51    70.00000  112.02700
   39    45    46    37.50000  110.70000
   39    45    47    37.50000  110.70000
   39    45    53    58.35000  112.70000
   43    39    40    37.50000  110.70000
   43    49    50    45.00000  112.01100
   43    49    59    90.00000  108.56700
   43    49    60    90.00000  108.56700
   43    51    52    35.00000  117.00000
   43    51    61    70.00000  124.00000
   49    43    44    45.00000  108.72000
   49    60    65    90.00000  112.10700
   59    33    34    35.00000  109.50000
   59    33    38    85.00000  110.90400
   59    49    50    35.00000  109.50000
   60    49    50    35.00000  109.50000
   60    49    59    92.60000  111.55000
   60    65    66    60.00000  105.75400
   60    65    70    90.00000  109.70700
   60    65    99   110.00000  113.16000
   65    70    71    45.00000  109.54000
   65    70    76    70.00000  111.10000
   65    70    78    90.00000  109.42000
   65    99    93    90.00000  112.10700
   70    65    66    45.00000  111.65000
   70    76    77    37.50000  110.70000
   70    76    85    58.35000  112.70000
   70    76    87    90.00000  111.45300
   70    78    79    65.00000  108.53500
   76    70    71    37.50000  110.70000
   76    85    86    37.50000  110.70000
   76    85    93    58.35000  112.70000
   76    85    95    90.00000  111.45300
   76    87    88    65.00000  108.53500
   85    76    77    37.50000  110.70000
   85    93    94    37.50000  110.70000
   85    93    99    95.00000  107.88500
   85    93   100    58.35000  112.70000
   85    95    96    65.00000  108.53500
   93    85    86    37.50000  110.70000
   93   100   101    37.50000  110.70000
   93   100   102    37.50000  110.70000
   93   100   105    90.00000  111.45300
   99    65    66    60.00000  105.75400
   99    65    70    90.00000  109.70700
   99    93    94    55.00000  108.98800
  100    93    94    37.50000  110.70000
  100    93    99    95.00000  107.88500
  100   105   106    65.00000  108.53500
  102   100   101    33.00000  107.80000
  105   100   101    60.00000  109.39000
  105   100   102    60.00000  109.39000
   95    85    86    60.00000  109.39000
   95    85    93    90.00000  111.45300
   87    76    77    60.00000  109.39000
   87    76    85    90.00000  111.45300
   78    70    71    60.00000  109.39000
   78    70    76    90.00000  111.45300
   51    43    44    35.00000  109.50000
   51    43    49    70.00000  112.02700
   51    61    62    35.00000  120.00000
   51    61    63    35.00000  120.00000
   61    51    52    35.00000  120.00000
   63    61    62    35.00000  117.00000
   45    39    40    37.50000  110.70000
   45    39    43    58.35000  112.70000
   45    53    54    37.50000  110.70000
   45    53    64    70.00000  113.44400
   45    53    91    56.20000  109.47000
   47    45    46    33.00000  107.80000
   53    45    46    37.50000  110.70000
   53    45    47    37.50000  110.70000
   53    64    67    55.00000  130.44200
   53    64    68    65.00000  122.56900
   53    91    82    51.80000  107.20000
   53    91    92    35.00000  109.50000
   64    53    54    45.00000  110.47400
   64    67    72    80.00000  105.82900
   64    67    73    55.00000  127.77900
   64    68   107    90.00000  107.14200
   64    68    69    35.00000  120.00000
   67    72    80    50.00000  134.85500
   67    72   107    80.00000  107.43600
   67    73    74    45.00000  111.11700
   67    73    75    45.00000  111.11700
   67    73    82    70.00000  112.62400
   72    80    81    35.00000  120.00000
   72    80    89    63.00000  120.00000
   72   107   103    85.00000  122.70000
   72   107    68    70.00000  104.40000
   80    89    90    35.00000  120.00000
   80    89    97    63.00000  120.00000
   89    80    81    35.00000  120.00000
   89    97    98    35.00000  120.00000
   89    97   103    63.00000  120.00000
   97    89    90    35.00000  120.00000
   97   103   104    35.00000  120.00000
   97   103   107    85.00000  120.00000
  103    97    98    35.00000  120.00000
  103   107    68    70.00000  132.80000
  107    72    80    85.00000  116.20000
  107   103   104    35.00000  120.00000
  107    68    69    35.00000  123.10000
   68    64    67    70.00000  106.30000
   73    67    72    55.00000  128.73000
   73    82    83    37.50000  110.70000
   73    82    84    37.50000  110.70000
   73    82    91    56.20000  109.47000
   75    73    74    33.00000  107.80000
   82    73    74    37.50000  110.70000
   82    73    75    37.50000  110.70000
   82    91    92    35.00000  109.50000
   84    82    83    33.00000  107.80000
   91    53    54    35.00000  109.50000
   91    53    64    75.00000  112.58000
   91    82    83    35.00000  109.50000
   91    82    84    35.00000  109.50000
   41    38    39    70.00000  124.00000
   41    48    55    90.00000  111.18400
   48    41    42    65.00000  121.00000
   48    55    56    35.00000  109.50000
   48    55    57    35.00000  109.50000
   48    55    58    35.00000  109.50000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    59   0.13850  1.0 1.0
   24    29    33    59  -1.34450 -1.0 2.0
   24    29    33    59   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    38    39   0.30250  1.0 1.0
   29    33    38    39  -0.14950 -1.0 2.0
   29    33    38    39   0.36900  1.0 3.0
   29    33    38    41   0.42700  1.0 1.0
   29    33    38    41  -0.70350 -1.0 2.0
   29    33    38    41  -0.43150  1.0 3.0
   29    33    59    49   0.14700  1.0 1.0
   29    33    59    49  -1.16150 -1.0 2.0
   29    33    59    49   0.48700  1.0 3.0
   33    38    39    40   0.34800  1.0 3.0
   33    38    39    43   0.46850  1.0 1.0
   33    38    39    43   0.08550 -1.0 2.0
   33    38    39    43   0.09800  1.0 3.0
   33    38    39    45   0.46850  1.0 1.0
   33    38    39    45   0.08550 -1.0 2.0
   33    38    39    45   0.09800  1.0 3.0
   33    38    41    42   7.00000 -1.0 2.0
   33    38    41    48   7.00000 -1.0 2.0
   34    33    38    39   0.34800  1.0 3.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    59    49   0.37050  1.0 3.0
   38    33    59    49  -0.77900  1.0 1.0
   38    33    59    49  -0.36900 -1.0 2.0
   38    33    59    49   0.40400  1.0 3.0
   38    39    43    44   0.15000  1.0 3.0
   38    39   -43    49   0.34400  1.0 1.0
   38    39   -43    49   0.09450 -1.0 2.0
   38    39   -43    49   0.11100  1.0 3.0
   38    39    43    51   0.31000  1.0 1.0
   38    39    43    51   0.14700 -1.0 2.0
   38    39    43    51   0.07550  1.0 3.0
   38    39    45    46   0.15000  1.0 3.0
   38    39    45    47   0.15000  1.0 3.0
   38    39    45    53   0.34400  1.0 1.0
   38    39    45    53   0.09450 -1.0 2.0
   38    39    45    53   0.11100  1.0 3.0
   38    41    48    55  -2.26850  1.0 1.0
   38    41    48    55   3.39050 -1.0 2.0
   39    38    41    42   7.00000 -1.0 2.0
   39    38    41    48   7.00000 -1.0 2.0
   39    43    49    50   0.15000  1.0 3.0
   39    43    49    59   0.62750  1.0 1.0
   39    43    49    59  -0.30950 -1.0 2.0
   39    43    49    59   0.27300  1.0 3.0
   39    43    49    60   0.62750  1.0 1.0
   39    43    49    60  -0.30950 -1.0 2.0
   39    43    49    60   0.27300  1.0 3.0
   39    43    51    52   0.00000  1.0 1.0
   39    43    51    61   0.09850  1.0 1.0
   39    43    51    61   0.15250 -1.0 2.0
   39    43    51    61  -0.50650  1.0 3.0
   39    45    53    54   0.15000  1.0 3.0
   39    45    53    64  -0.03700  1.0 1.0
   39    45    53    64   0.37200 -1.0 2.0
   39    45    53    64  -0.47300  1.0 3.0
   39    45    53    91   1.53400  1.0 1.0
   39    45    53    91  -0.09950 -1.0 2.0
   39    45    53    91   0.05700  1.0 3.0
   40    39    43    44   0.15000  1.0 3.0
   40    39    43    49   0.15000  1.0 3.0
   40    39    43    51   0.15000  1.0 3.0
   40    39    45    46   0.15000  1.0 3.0
   40    39    45    47   0.15000  1.0 3.0
   40    39    45    53   0.15000  1.0 3.0
   43    39    45    46   0.15000  1.0 3.0
   43    39    45    47   0.15000  1.0 3.0
   43    39    45    53   0.56750  1.0 1.0
   43    39    45    53  -0.07550 -1.0 2.0
   43    39    45    53   0.20000  1.0 3.0
   43    49   -59    33   0.06250  1.0 1.0
   43    49   -59    33  -0.01100 -1.0 2.0
   43    49   -59    33   0.28050  1.0 3.0
   43    49    60    65   0.06250  1.0 1.0
   43    49    60    65  -0.01100 -1.0 2.0
   43    49    60    65   0.28050  1.0 3.0
   43    51    61    62   7.00000 -1.0 2.0
   43    51    61    63   7.00000 -1.0 2.0
   44    43    49    50   0.15000  1.0 3.0
   44    43    49    59   0.23400  1.0 3.0
   44    43    49    60   0.23400  1.0 3.0
   44    43    51    52   0.33100  1.0 3.0
   44    43    51    61   0.00000  1.0 1.0
   49    43    51    52   0.00000  1.0 1.0
   49    43    51    61   0.09850  1.0 1.0
   49    43    51    61   0.15250 -1.0 2.0
   49    43    51    61  -0.50650  1.0 3.0
   49    60    65    66   0.37050  1.0 3.0
   49    60    65    70   0.06250  1.0 1.0
   49    60    65    70  -0.01100 -1.0 2.0
   49    60    65    70   0.28050  1.0 3.0
   49    60    65    99  -0.12700  1.0 1.0
   49    60    65    99  -1.16200 -1.0 2.0
   49    60    65    99   0.58800  1.0 3.0
   50    49    59    33   0.37050  1.0 3.0
   50    49    60    65   0.37050  1.0 3.0
   59    33   -38    39   0.09700  1.0 1.0
   59    33   -38    39   0.15600 -1.0 2.0
   59    33   -38    39  -0.50800  1.0 3.0
   59    33    38    41   0.39000  1.0 1.0
   59    33    38    41  -0.05800 -1.0 2.0
   59    33    38    41  -0.55150  1.0 3.0
   59    49    60    65  -0.53350  1.0 1.0
   59    49    60    65  -0.78350 -1.0 2.0
   59    49    60    65   0.33750  1.0 3.0
   60    49    59    33  -0.81800  1.0 1.0
   60    65    70    71   0.23400  1.0 3.0
   60    65    70    76   0.62750  1.0 1.0
   60    65    70    76  -0.30950 -1.0 2.0
   60    65    70    76   0.27300  1.0 3.0
   60    65    70    78   1.51850  1.0 1.0
   60    65    99    93  -0.70400  1.0 1.0
   60    65    99    93  -0.90350 -1.0 2.0
   65    70    76    77   0.15000  1.0 3.0
   65    70    76    85   0.56750  1.0 1.0
   65    70    76    85  -0.07550 -1.0 2.0
   65    70    76    85   0.20000  1.0 3.0
   65    70    76    87  -0.47750  1.0 1.0
   65    70    78    79   0.29150  1.0 1.0
   65    70    78    79  -0.28350 -1.0 2.0
   65    70    78    79   0.43600  1.0 3.0
   66    65    70    71   0.15000  1.0 3.0
   66    65    70    76   0.15000  1.0 3.0
   66    65    70    78   0.23400  1.0 3.0
   66    65    99    93   0.37050  1.0 3.0
   70    65    99    93   0.06250  1.0 1.0
   70    65    99    93  -0.01100 -1.0 2.0
   70    65    99    93   0.28050  1.0 3.0
   70    76    85    86   0.15000  1.0 3.0
   70    76   -85    93   0.56750  1.0 1.0
   70    76   -85    93  -0.07550 -1.0 2.0
   70    76   -85    93   0.20000  1.0 3.0
   70    76    85    95  -0.47750  1.0 1.0
   70    76    87    88   0.29150  1.0 1.0
   70    76    87    88  -0.28350 -1.0 2.0
   70    76    87    88   0.43600  1.0 3.0
   71    70    76    77   0.15000  1.0 3.0
   71    70    76    85   0.15000  1.0 3.0
   71    70    76    87   0.23400  1.0 3.0
   71    70    78    79   0.19450  1.0 3.0
   76    70    78    79   0.29150  1.0 1.0
   76    70    78    79  -0.28350 -1.0 2.0
   76    70    78    79   0.43600  1.0 3.0
   76    85    93    94   0.15000  1.0 3.0
   76    85    93    99   0.62750  1.0 1.0
   76    85    93    99  -0.30950 -1.0 2.0
   76    85    93    99   0.27300  1.0 3.0
   76    85    93   100   0.56750  1.0 1.0
   76    85    93   100  -0.07550 -1.0 2.0
   76    85    93   100   0.20000  1.0 3.0
   76    85    95    96   0.29150  1.0 1.0
   76    85    95    96  -0.28350 -1.0 2.0
   76    85    95    96   0.43600  1.0 3.0
   77    76    85    86   0.15000  1.0 3.0
   77    76    85    93   0.15000  1.0 3.0
   77    76    85    95   0.23400  1.0 3.0
   77    76    87    88   0.19450  1.0 3.0
   85    76    87    88   0.29150  1.0 1.0
   85    76    87    88  -0.28350 -1.0 2.0
   85    76    87    88   0.43600  1.0 3.0
   85    93   -99    65   0.06250  1.0 1.0
   85    93   -99    65  -0.01100 -1.0 2.0
   85    93   -99    65   0.28050  1.0 3.0
   85    93   100   101   0.15000  1.0 3.0
   85    93   100   102   0.15000  1.0 3.0
   85    93   100   105  -0.47750  1.0 1.0
   86    85    93    94   0.15000  1.0 3.0
   86    85    93    99   0.23400  1.0 3.0
   86    85    93   100   0.15000  1.0 3.0
   86    85    95    96   0.19450  1.0 3.0
   93    85    95    96   0.29150  1.0 1.0
   93    85    95    96  -0.28350 -1.0 2.0
   93    85    95    96   0.43600  1.0 3.0
   93   100   105   106   0.29150  1.0 1.0
   93   100   105   106  -0.28350 -1.0 2.0
   93   100   105   106   0.43600  1.0 3.0
   94    93    99    65   0.37050  1.0 3.0
   94    93   100   101   0.15000  1.0 3.0
   94    93   100   102   0.15000  1.0 3.0
   94    93   100   105   0.23400  1.0 3.0
   99    65    70    71   0.23400  1.0 3.0
   99    65   -70    76   0.62750  1.0 1.0
   99    65   -70    76  -0.30950 -1.0 2.0
   99    65   -70    76   0.27300  1.0 3.0
   99    65    70    78   1.51850  1.0 1.0
   99    93   100   101   0.23400  1.0 3.0
   99    93   100   102   0.23400  1.0 3.0
   99    93   100   105   1.51850  1.0 1.0
  100    93    99    65   0.06250  1.0 1.0
  100    93    99    65  -0.01100 -1.0 2.0
  100    93    99    65   0.28050  1.0 3.0
  101   100   105   106   0.19450  1.0 3.0
  102   100   105   106   0.19450  1.0 3.0
   95    85    93    94   0.23400  1.0 3.0
   95    85    93    99   1.51850  1.0 1.0
   95    85    93   100  -0.47750  1.0 1.0
   87    76    85    86   0.23400  1.0 3.0
   87    76    85    93  -0.47750  1.0 1.0
   87    76    85    95   3.77950  1.0 1.0
   78    70    76    77   0.23400  1.0 3.0
   78    70    76    85  -0.47750  1.0 1.0
   78    70    76    87   3.77950  1.0 1.0
   51    43    49    50   0.15000  1.0 3.0
   51    43    49    59   0.61850  1.0 1.0
   51    43    49    59  -0.22750 -1.0 2.0
   51    43    49    59   0.15300  1.0 3.0
   51    43    49    60   0.61850  1.0 1.0
   51    43    49    60  -0.22750 -1.0 2.0
   51    43    49    60   0.15300  1.0 3.0
   52    51    61    62   7.00000 -1.0 2.0
   52    51    61    63   7.00000 -1.0 2.0
   45    39    43    44   0.15000  1.0 3.0
   45    39    43    49   3.97050  1.0 1.0
   45    39    43    51   0.34400  1.0 1.0
   45    39    43    51   0.09450 -1.0 2.0
   45    39    43    51   0.11100  1.0 3.0
   45    53    64    67   0.04150 -1.0 2.0
   45    53    64    68   0.39850  1.0 1.0
   45    53    64    68   0.06450 -1.0 2.0
   45    53    64    68   0.32400  1.0 3.0
   45    53    91    82   0.23450  1.0 1.0
   45    53    91    82   0.02050 -1.0 2.0
   45    53    91    82   0.25250  1.0 3.0
   45    53    91    92  -0.05950  1.0 1.0
   45    53    91    92   0.08850 -1.0 2.0
   45    53    91    92   0.11750  1.0 3.0
   46    45    53    54   0.15000  1.0 3.0
   46    45    53    64   0.43200  1.0 3.0
   46    45    53    91   0.15000  1.0 3.0
   47    45    53    54   0.15000  1.0 3.0
   47    45    53    64   0.43200  1.0 3.0
   47    45    53    91   0.15000  1.0 3.0
   53    64    67    72   3.62500 -1.0 2.0
   53    64    67    73   3.62500 -1.0 2.0
   53    64    68   107   3.62500 -1.0 2.0
   53    64    68    69   2.00000 -1.0 2.0
   54    53    64    67   0.00000  1.0 1.0
   54    53    64    68   0.00000  1.0 1.0
   54    53    91    82   0.28000  1.0 3.0
   54    53    91    92   0.20000  1.0 3.0
   64    53    91    82   0.82600  1.0 1.0
   64    53    91    82  -0.32100 -1.0 2.0
   64    53    91    82   1.02000  1.0 3.0
   64    53    91    92   0.76500  1.0 1.0
   64    53    91    92   0.05700 -1.0 2.0
   64    53    91    92  -0.90900  1.0 3.0
   64    67    72    80   3.62500 -1.0 2.0
   64    67   -72   107   3.50000 -1.0 2.0
   64    67    73    74   0.00000  1.0 1.0
   64    67    73    75   0.00000  1.0 1.0
   64    67   -73    82   0.04150 -1.0 2.0
   67    64   -68   107   3.62500 -1.0 2.0
   67    64    68    69   1.40000 -1.0 2.0
   67    72    80    81   3.62500 -1.0 2.0
   67    72    80    89   3.62500 -1.0 2.0
   67    72   107   103   3.00000 -1.0 2.0
   67    72  -107    68   3.00000 -1.0 2.0
   67    73    82    83   0.43200  1.0 3.0
   67    73    82    84   0.43200  1.0 3.0
   67    73    82    91   0.83750  1.0 1.0
   67    73    82    91   0.32200 -1.0 2.0
   67    73    82    91   0.70600  1.0 3.0
   72    67    73    74   0.00000  1.0 1.0
   72    67    73    75   0.00000  1.0 1.0
   72    67    73    82   0.04150 -1.0 2.0
   72    80    89    90   3.62500 -1.0 2.0
   72    80    89    97   3.62500 -1.0 2.0
   72   107   -68    64   3.62500 -1.0 2.0
   72   107    68    69   1.52500 -1.0 2.0
   80    72   107   103   3.00000 -1.0 2.0
   80    72   107    68   3.00000 -1.0 2.0
   80    89    97    98   3.62500 -1.0 2.0
   80    89   -97   103   3.62500 -1.0 2.0
   81    80    89    90   3.62500 -1.0 2.0
   81    80    89    97   3.62500 -1.0 2.0
   89    97   103   104   3.62500 -1.0 2.0
   89    97   103   107   3.62500 -1.0 2.0
   90    89    97    98   3.62500 -1.0 2.0
   90    89    97   103   3.62500 -1.0 2.0
   97   103  -107    72   3.62500 -1.0 2.0
   97   103   107    68   3.62500 -1.0 2.0
   98    97   103   104   3.62500 -1.0 2.0
   98    97   103   107   3.62500 -1.0 2.0
  103   107    68    64   3.62500 -1.0 2.0
  103   107    68    69   1.52500 -1.0 2.0
  104   103   107    72   3.62500 -1.0 2.0
  104   103   107    68   3.62500 -1.0 2.0
  107    72    80    81   3.50000 -1.0 2.0
  107    72   -80    89   3.50000 -1.0 2.0
   68    64   -67    72   3.62500 -1.0 2.0
   68    64    67    73   3.62500 -1.0 2.0
   73    67    72    80   3.62500 -1.0 2.0
   73    67    72   107   3.62500 -1.0 2.0
   73    82   -91    53   0.23450  1.0 1.0
   73    82   -91    53   0.02050 -1.0 2.0
   73    82   -91    53   0.25250  1.0 3.0
   73    82    91    92  -0.15950  1.0 1.0
   73    82    91    92   0.34650 -1.0 2.0
   73    82    91    92   0.05750  1.0 3.0
   74    73    82    83   0.15000  1.0 3.0
   74    73    82    84   0.15000  1.0 3.0
   74    73    82    91   0.15000  1.0 3.0
   75    73    82    83   0.15000  1.0 3.0
   75    73    82    84   0.15000  1.0 3.0
   75    73    82    91   0.15000  1.0 3.0
   83    82    91    53   0.28000  1.0 3.0
   83    82    91    92   0.20000  1.0 3.0
   84    82    91    53   0.28000  1.0 3.0
   84    82    91    92   0.20000  1.0 3.0
   91    53   -64    67   0.18550 -1.0 2.0
   91    53   -64    67   0.14000  1.0 3.0
   91    53    64    68   0.04300 -1.0 2.0
   41    38    39    40   0.00000  1.0 1.0
   41    38    39    43   0.09850  1.0 1.0
   41    38    39    43   0.15250 -1.0 2.0
   41    38    39    43  -0.50650  1.0 3.0
   41    38    39    45   0.09850  1.0 1.0
   41    38    39    45   0.15250 -1.0 2.0
   41    38    39    45  -0.50650  1.0 3.0
   41    48    55    56   0.08050  1.0 3.0
   41    48    55    57   0.08050  1.0 3.0
   41    48    55    58   0.08050  1.0 3.0
   42    41    48    55   2.00000 -1.0 2.0
IPHI
    9     5     7     8  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
   37    30    35    36  10.50000 -1.0 2.0
   33    39    38    41   1.10000 -1.0 2.0
   43    52    51    61  15.00000 -1.0 2.0
   62    63    61    51  15.00000 -1.0 2.0
   67    68    64    53   4.00000 -1.0 2.0
   72    73    67    64   4.00000 -1.0 2.0
   80   107    72    67   4.00000 -1.0 2.0
   89    81    80    72   1.10000 -1.0 2.0
   97    90    89    80   1.10000 -1.0 2.0
  103    98    97    89   1.10000 -1.0 2.0
  107   104   103    97   1.10000 -1.0 2.0
  103    68   107    72   4.00000 -1.0 2.0
   69    64    68   107   1.00000 -1.0 2.0
   42    48    41    38   1.10000 -1.0 2.0
END
