* LIGAND DATABASE FILE (OPLS2005)
*
001     113   116    206    321     593
    1     0 S   NP   _N1_     1    28.38839    97.14278   -22.88705
    2     1 S   H    _HN1     2     1.02829    40.71702   168.42395
    3     1 S   H    _H1_     3     1.02786   101.43574   -87.37453
    4     1 S   H    _H2_     4     1.02950    71.37453    18.34873
    5     1 S   CT   _CA1     5     1.50108   142.84605   117.82281
    6     5 S   HC   _HA1     6     1.09573   105.19717    91.85996
    7     5 S   CO3  _C1_     7     1.53781   112.46598   -28.38341
    8     7 S   O2Z  _O11     8     1.26371   115.00503   -42.61884
    9     7 S   O2Z  _O12     9     1.26239   114.94313   136.52408
   10     5 S   CT   _CB1    10     1.53078   107.42393  -150.15344
   11    10 S   HC   HB11    11     1.09834   109.36716   -49.73139
   12    10 S   HC   HB12    12     1.09812   110.45136    66.87301
   13    10 S   CT   _CG1    13     1.52994   112.60922  -170.70821
   14    13 S   HC   HG11    14     1.09582   110.64509   -65.78591
   15    13 S   HC   HG12    15     1.09670   109.78093    53.45183
   16    13 S   C    _CD1    16     1.51798   112.20249   173.90635
   17    16 S   O    _OE1    17     1.22733   123.28404     7.39839
   18    16 S   N    _N2_    18     1.38655   111.68371  -172.72468
   19    18 S   H    _HN2    19     1.01582   118.92967     1.73923
   20    18 S   CT1  _CA2    20     1.46200   123.36159   177.31183
   21    20 S   HC   _HA2    21     1.09733   109.40065     2.51061
   22    20 S   C    _C2_    22     1.53557   108.58868  -113.00611
   23    22 S   O    _O2_    23     1.23058   122.26616  -147.99435
   24    20 S   CT   _CB2    32     1.53367   111.54345   124.59595
   25    24 S   HC   HB21    33     1.09425   109.73327    56.77218
   26    24 S   HC   HB22    34     1.09456   109.85203   175.58869
   27    22 S   N    _N3_    24     1.38317   113.70937    39.42066
   28    27 S   H    _HN3    25     1.01584   119.58732    -3.25937
   29    24 S   S    _SG2    35     1.82932   111.33203   -64.99202
   30    27 S   CT   _CA3    26     1.45287   123.23230   177.17201
   31    30 S   HC   HA31    27     1.09548   107.50348   -64.86334
   32    30 S   HC   HA32    28     1.09556   107.99901    51.58496
   33    29 S   CT   _C22    36     1.86289   101.14243   167.18581
   34    30 S   CO3  _C3_    29     1.52964   114.05984   173.58690
   35    34 S   O2Z  _O31    30     1.26378   116.06191    -0.65938
   36    34 S   O2Z  _O32    31     1.26426   114.41412   179.40554
   37    33 S   CM   _C21    37     1.52604   107.33214   178.35218
   38    33 S   CT   _C27   110     1.53643   110.18662    57.62240
   39    38 S   HC   _H18   111     1.09500   112.20705   -69.69263
   40    38 S   HC   _H19   112     1.09685   111.19130   170.33973
   41    38 S   HC   _H20   113     1.09663   111.99180    51.17713
   42    37 S   N    _N7_    38     1.36623   108.92689   114.91299
   43    42 S   H    _H14    39     1.01432   122.30497  -179.66957
   44    37 S   CM   _C20    49     1.34456   126.86823   -66.16959
   45    44 S   HC   _H13    50     1.08465   119.66959     1.47020
   46    42 S   C    _C24    40     1.37693   115.03154     1.03249
   47    46 S   O    _O34    41     1.22257   126.21172   179.00850
   48    44 S   CD   _C19    51     1.48273   123.22045  -178.56196
   49    33 S   CT   _C23    42     1.56931   109.61098   -70.11293
   50    49 S   HC   _H4_    43     1.09828   111.45208     0.02798
   51    48 S   CM   _C18    52     1.47422   119.74590  -165.07477
   52    49 S   CM   _C25    44     1.50575   117.06060   127.56963
   53    52 S   HC   _H15    45     1.08721   118.12963    59.51062
   54    51 S   CM   _C17    53     1.34318   101.58874  -179.22570
   55    51 S   CT   _C28   106     1.47968   126.48051     0.78260
   56    55 S   HC   _H21   107     1.09459   110.53159   -60.18047
   57    55 S   HC   _H22   108     1.09342   112.26804  -179.84423
   58    55 S   HC   _H23   109     1.09453   110.53324    60.00598
   59    52 S   CM   _C26    46     1.33838   123.80539  -121.57087
   60    59 S   HC   _H16    47     1.08488   120.42863  -179.37568
   61    59 S   HC   _H17    48     1.08449   121.68209     0.48578
   62    54 S   CM   _C16    54     1.45655   110.04039     0.03956
   63    54 S   CT   _C29    97     1.50112   126.22059  -178.90033
   64    63 S   HC   _H24    98     1.09697   109.86741    23.34337
   65    63 S   HC   _H25    99     1.09707   110.16817   138.20652
   66    48 S   NI   _N6_    55     1.29953   125.67255    16.21670
   67    62 S   CM   _C15    56     1.34624   127.13257  -179.29891
   68    67 S   HC   _H12    57     1.08653   119.29953     0.94998
   69    63 S   CT   _C30   100     1.52699   112.09810   -98.27115
   70    69 S   HC   _H26   101     1.09701   110.15007   -61.95053
   71    69 S   HC   _H27   102     1.09786   109.61377    55.67346
   72    67 S   C5A  _C14    58     1.42645   124.76369  -179.93744
   73    69 S   CO3  _C31   103     1.53186   114.81953   176.65842
   74    73 S   O2Z  _O36   104     1.26516   114.03387  -175.93572
   75    73 S   O2Z  _O35   105     1.26128   116.66648     3.97345
   76    72 S   C5BC _C13    59     1.38988   133.14101  -166.15153
   77    76 S   C5BC _C12    60     1.44165   107.45704  -179.88809
   78    76 S   CT   _C32    88     1.50025   126.63953     0.90309
   79    78 S   HC   _H28    89     1.09734   109.58212    32.21937
   80    78 S   HC   _H29    90     1.09729   109.24479   147.65045
   81    77 S   C5A  _C11    61     1.38374   107.06402     1.50818
   82    77 S   CT   _C35    84     1.48789   126.17850  -178.61280
   83    82 S   HC   _H32    85     1.09464   110.20606    69.10618
   84    82 S   HC   _H33    86     1.09447   111.74465  -170.74613
   85    82 S   HC   _H34    87     1.09459   110.59996   -50.83671
   86    78 S   CT   _C33    91     1.52548   112.23619   -90.18181
   87    86 S   HC   _H30    92     1.09756   109.76907    61.53324
   88    86 S   HC   _H31    93     1.09763   109.79900   -55.61412
   89    72 S   NA   _N5_    62     1.37225   120.12115    15.05669
   90    89 S   H    _H11    63     1.01111   124.07256    -0.76719
   91    81 S   CM   _C10    64     1.41593   134.41667  -176.52904
   92    91 S   HC   _H10    65     1.08823   115.73485    52.27414
   93    86 S   CO3  _C34    94     1.53111   114.81624  -176.95644
   94    93 S   O2Z  _O38    95     1.26522   114.06979   176.49541
   95    93 S   O2Z  _O37    96     1.26142   116.67795    -3.39511
   96    91 S   CM   _C9_    66     1.34423   125.21247  -131.60290
   97    96 S   CM   _C6_    67     1.45989   132.66537     6.81705
   98    97 S   CT   _C7_    68     1.51885   107.64690  -163.45267
   99    98 S   HC   _H3_    69     1.09545   111.54678  -129.06081
  100    97 S   CM   _C5_    78     1.34508   126.90064    25.69920
  101   100 S   HC   _H8_    79     1.08656   119.88331    -3.15585
  102    98 S   C    _C8_    70     1.51846   101.90525   -14.01845
  103   102 S   O    _O33    71     1.22211   125.44636  -172.79347
  104    98 S   CT   _C36    74     1.52230   112.89439   104.25983
  105   104 S   HC   _H35    75     1.09497   111.61954   -54.87499
  106   104 S   HC   _H36    76     1.09537   110.66987  -174.33272
  107   104 S   HC   _H37    77     1.09454   111.36767    65.59658
  108   100 S   CT   _C4_    80     1.49553   126.53856   175.46611
  109   108 S   HC   _H5_    81     1.09447   109.66467  -120.88996
  110   108 S   HC   _H6_    82     1.09451   109.60961   120.50269
  111   108 S   HC   _H7_    83     1.09239   113.45271    -0.20653
  112    96 S   N    _N4_    72     1.36880   120.42235  -169.99091
  113   112 S   H    _H9_    73     1.01341   123.20986    -6.13715
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  12   5   4   3
  17   2   1   1  16   9   3   2   1   9   4   9   3   6   3  10
   6   3  12   4   3  16   6   2   1   1   2   1   1  10  10   5
   4   3   8   3   5   4   3  11   2   1   1  16  14  11   5   4
  11   5   2   1   1   5   4   3   4   1   8   3   2   1   1  11
  16  12   8   8   4   7   3   4   2   1   1   3   2   1   1   1
   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    49    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    42    46    49    50    52    44    38    39    40    41  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    42    43    46    47    49    50    52    53    59    44    45    48    38    39    40    41  
   35    36  
   36  
    0  
   42    43    46    47    49    50    52    44    45    48    51    66    38    39    40    41  
   39    40    41    42    44    46    49    50    52  
   40    41    49  
   41    49  
   49  
   43    46    47    49    50    52    44    45    48  
   46    47    49    44  
   45    48    51    54    62    66    55    46    49  
   48    51    66  
   47    49    50    52    53    59  
   49    50    52  
   51    54    62    66    67    63    55    56    57    58  
   50    52    53    59    60    61  
   52    53    59  
   54    62    66    67    63    64    65    69    55    56    57    58  
   53    59    60    61  
   59    60    61  
   62    66    67    68    72    63    64    65    69    70    71    73    55    56    57    58  
   56    57    58    62    63    66  
   57    58  
   58  
    0  
   60    61  
   61  
    0  
   66    67    68    72    76    89    63    64    65    69  
   64    65    69    70    71    73    74    75    66    67  
   65    69    70    71    73  
   69    70    71    73  
   67    68    72  
   68    72    76    77    81    89    90    78  
   72    76    89  
   70    71    73    74    75  
   71    73    74    75  
   73    74    75  
   76    77    81    89    90    91    82    78    79    80    86  
   74    75  
   75  
    0  
   77    81    89    90    91    82    83    84    85    78    79    80    86    87    88    93  
   81    89    90    91    92    96    82    83    84    85    78    79    80    86  
   79    80    86    87    88    93    94    95    81    82    89  
   80    86    87    88    93  
   86    87    88    93  
   89    90    91    92    96    97   112    82    83    84    85  
   83    84    85    89    91  
   84    85  
   85  
    0  
   87    88    93    94    95  
   88    93    94    95  
   93    94    95  
   90    91    92    96  
   91  
   92    96    97    98   102   112   113   100  
   96    97   112  
   94    95  
   95  
    0  
   97    98    99   102   103   112   113   104   100   101   108  
   98    99   102   103   112   113   104   105   106   107   100   101   108   109   110   111  
   99   102   103   112   113   104   105   106   107   100   101   108  
  102   103   112   104   105   106   107   100  
  101   108   109   110   111   102   104   112  
  108   109   110   111  
  103   112   113   104   105   106   107  
  112   113   104  
  105   106   107   112  
  106   107  
  107  
    0  
  109   110   111  
  110   111  
  111  
    0  
  113  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.335000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   38   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
   43   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   44   3.5500   0.0760  -0.118300   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   48   3.7500   0.1050   0.396300   2.0020   1.7750   0.023028004  -0.852763146
   49   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0760  -0.003300   2.0020   1.7750   0.023028004  -0.852763146
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   55   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0760   0.122500   2.0020   1.7750   0.023028004  -0.852763146
   63   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.2800   0.1700  -0.512200   1.8540   1.6400   0.005000000   0.000000000
   67   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   68   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   72   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   73   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   74   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   75   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   76   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   77   3.5500   0.0700  -0.146000   2.0020   1.7750   0.001000000  -0.843144165
   78   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5500   0.0700  -0.008000   2.0020   1.7750   0.001000000  -0.843144165
   82   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   89   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   90   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   91   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   92   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   93   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   94   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   95   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   96   3.5500   0.0760   0.051300   2.0020   1.7750   0.023028004  -0.852763146
   97   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   98   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  101   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  102   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
  103   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
  104   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   3.2500   0.1700  -0.351300   1.8100   1.6000   0.054801302  -1.445846770
  113   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    49   268.000  1.529
   33    38   268.000  1.529
   37    42   400.000  1.384
   37    44   549.000  1.340
   42    43   434.000  1.010
   42    46   490.000  1.335
   46    47   570.000  1.229
   46    49   317.000  1.522
   49    50   340.000  1.090
   49    52   317.000  1.510
   52    53   340.000  1.080
   52    59   549.000  1.340
   59    60   340.000  1.080
   59    61   340.000  1.080
   44    45   340.000  1.080
   44    48   320.000  1.464
   48    51   320.000  1.464
   48    66   500.000  1.261
   51    54   549.000  1.340
   51    55   317.000  1.510
   54    62   380.000  1.444
   54    63   317.000  1.510
   62    66   405.000  1.380
   62    67   549.000  1.340
   67    68   340.000  1.080
   67    72   375.000  1.423
   72    76   546.000  1.367
   72    89   427.000  1.381
   76    77   469.000  1.424
   76    78   285.000  1.502
   77    81   546.000  1.367
   77    82   285.000  1.502
   81    89   427.000  1.381
   81    91   375.000  1.423
   89    90   434.000  1.010
   91    92   340.000  1.080
   91    96   549.000  1.340
   96    97   380.000  1.444
   96   112   400.000  1.384
   97    98   317.000  1.510
   97   100   549.000  1.340
   98    99   340.000  1.090
   98   102   317.000  1.522
   98   104   268.000  1.529
  102   103   570.000  1.229
  102   112   490.000  1.335
  112   113   434.000  1.010
  104   105   340.000  1.090
  104   106   340.000  1.090
  104   107   340.000  1.090
  100   101   340.000  1.080
  100   108   317.000  1.510
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   340.000  1.090
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    86   268.000  1.529
   86    87   340.000  1.090
   86    88   340.000  1.090
   86    93   317.000  1.522
   93    94   656.000  1.250
   93    95   656.000  1.250
   63    64   340.000  1.090
   63    65   340.000  1.090
   63    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    73   317.000  1.522
   73    74   656.000  1.250
   73    75   656.000  1.250
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    58   340.000  1.090
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  112.20000
   29    33    49    75.00000  111.63000
   29    33    38    75.00000  111.63000
   33    37    42    70.00000  113.82800
   33    37    44    70.00000  124.00000
   33    49    46    63.00000  111.10000
   33    49    50    37.50000  110.70000
   33    49    52    70.00000  112.02700
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   37    42    43    45.00000  117.55000
   37    42    46    70.00000  120.89900
   37    44    45    35.00000  120.00000
   37    44    48    60.00000  120.31500
   42    46    47    80.00000  122.90000
   42    46    49    70.00000  116.60000
   46    42    43    35.00000  119.80000
   46    49    50    35.00000  109.50000
   46    49    52    70.00000  115.00700
   49    33    37    70.00000  112.02700
   49    46    47    80.00000  120.40000
   49    52    53    35.00000  117.00000
   49    52    59    70.00000  124.00000
   52    49    50    35.00000  109.50000
   52    59    60    35.00000  120.00000
   52    59    61    35.00000  120.00000
   59    52    53    35.00000  120.00000
   61    59    60    35.00000  117.00000
   44    37    42    75.00000  120.83300
   44    48    51    65.00000  123.36000
   44    48    66    70.00000  121.86000
   48    44    45    40.00000  114.85300
   48    51    54    60.00000  120.31500
   48    51    55    65.00000  117.22000
   48    66    62    75.00000  115.77100
   51    54    62    70.00000  123.01800
   51    54    63    70.00000  124.00000
   51    55    56    35.00000  109.50000
   51    55    57    35.00000  109.50000
   51    55    58    35.00000  109.50000
   54    62    66    70.00000  120.83400
   54    62    67    70.00000  123.01800
   54    63    64    35.00000  109.50000
   54    63    65    35.00000  109.50000
   54    63    69    70.00000  112.02700
   62    67    68    35.00000  120.00000
   62    67    72    55.00000  128.24000
   66    48    51    70.00000  121.86000
   67    62    66    70.00000  120.83400
   67    72    76    50.00000  133.16000
   67    72    89    70.00000  120.38000
   72    67    68    40.00000  117.26300
   72    76    77    70.00000  107.30000
   72    76    78    60.00000  130.00000
   72    89    81    70.00000  109.80000
   72    89    90    35.00000  120.00000
   76    77    81    70.00000  107.30000
   76    77    82    60.00000  130.00000
   76    78    79    35.00000  109.50000
   76    78    80    35.00000  109.50000
   76    78    86    70.00000  112.17500
   77    81    89    70.00000  107.70000
   77    81    91    50.00000  133.16000
   77    82    83    35.00000  109.50000
   77    82    84    35.00000  109.50000
   77    82    85    35.00000  109.50000
   81    89    90    35.00000  120.00000
   81    91    92    40.00000  117.26300
   81    91    96    55.00000  128.24000
   89    72    76    70.00000  107.70000
   91    81    89    70.00000  120.38000
   91    96    97    70.00000  123.01800
   91    96   112    75.00000  120.83300
   96    91    92    35.00000  120.00000
   96    97    98    70.00000  124.00000
   96    97   100    70.00000  123.01800
   96   112   102    70.00000  120.89900
   96   112   113    45.00000  117.55000
   97    98    99    35.00000  109.50000
   97    98   102    70.00000  115.00700
   97    98   104    70.00000  112.02700
   97   100   101    35.00000  120.00000
   97   100   108    70.00000  124.00000
   98   102   103    80.00000  120.40000
   98   102   112    70.00000  116.60000
   98   104   105    37.50000  110.70000
   98   104   106    37.50000  110.70000
   98   104   107    37.50000  110.70000
  102    98    99    35.00000  109.50000
  102   112   113    35.00000  119.80000
  112    96    97    75.00000  120.83300
  112   102   103    80.00000  122.90000
  104    98    99    37.50000  110.70000
  104    98   102    63.00000  111.10000
  106   104   105    33.00000  107.80000
  107   104   105    33.00000  107.80000
  107   104   106    33.00000  107.80000
  100    97    98    70.00000  124.00000
  100   108   109    35.00000  109.50000
  100   108   110    35.00000  109.50000
  100   108   111    35.00000  109.50000
  108   100   101    35.00000  117.00000
  110   108   109    33.00000  107.80000
  111   108   109    33.00000  107.80000
  111   108   110    33.00000  107.80000
   82    77    81    60.00000  130.00000
   84    82    83    33.00000  107.80000
   85    82    83    33.00000  107.80000
   85    82    84    33.00000  107.80000
   78    76    77    60.00000  130.00000
   78    86    87    37.50000  110.70000
   78    86    88    37.50000  110.70000
   78    86    93    70.00000  109.69300
   80    78    79    33.00000  107.80000
   86    78    79    37.50000  110.70000
   86    78    80    37.50000  110.70000
   86    93    94    70.00000  117.00000
   86    93    95    70.00000  117.00000
   88    86    87    33.00000  107.80000
   93    86    87    35.00000  109.50000
   93    86    88    35.00000  109.50000
   95    93    94    80.00000  126.00000
   63    54    62    70.00000  124.00000
   63    69    70    37.50000  110.70000
   63    69    71    37.50000  110.70000
   63    69    73    70.00000  109.69300
   65    63    64    33.00000  107.80000
   69    63    64    37.50000  110.70000
   69    63    65    37.50000  110.70000
   69    73    74    70.00000  117.00000
   69    73    75    70.00000  117.00000
   71    69    70    33.00000  107.80000
   73    69    70    35.00000  109.50000
   73    69    71    35.00000  109.50000
   75    73    74    80.00000  126.00000
   55    51    54    70.00000  124.00000
   57    55    56    33.00000  107.80000
   58    55    56    33.00000  107.80000
   58    55    57    33.00000  107.80000
   38    33    37    70.00000  112.02700
   38    33    49    58.35000  112.70000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  1.0 3.0
   24    29    33    49   0.01700  1.0 1.0
   24    29    33    49  -0.23550 -1.0 2.0
   24    29    33    49   0.21350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    42   0.09700  1.0 1.0
   29    33    37    42   0.15600 -1.0 2.0
   29    33    37    42  -0.50800  1.0 3.0
   29    33    37    44   0.42700  1.0 1.0
   29    33    37    44  -0.70350 -1.0 2.0
   29    33    37    44  -0.43150  1.0 3.0
   29    33    49    46   0.56750  1.0 1.0
   29    33    49    46  -0.07550 -1.0 2.0
   29    33    49    46   0.20000  1.0 3.0
   29    33    49    50   0.15000  1.0 3.0
   29    33    49    52   0.56750  1.0 1.0
   29    33    49    52  -0.07550 -1.0 2.0
   29    33    49    52   0.20000  1.0 3.0
   29    33    38    39   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.15000  1.0 3.0
   33    37    42    43   2.40850 -1.0 2.0
   33    37   -42    46  -0.45200  1.0 1.0
   33    37   -42    46   0.85900 -1.0 2.0
   33    37   -42    46   0.16650  1.0 3.0
   33    37    44    45   7.00000 -1.0 2.0
   33    37    44    48   7.00000 -1.0 2.0
   33    49    52    53   0.00000  1.0 1.0
   33    49    52    59   0.09850  1.0 1.0
   33    49    52    59   0.15250 -1.0 2.0
   33    49    52    59  -0.50650  1.0 3.0
   37    33   -49    46  -0.98800  1.0 1.0
   37    33   -49    46   0.48800 -1.0 2.0
   37    33   -49    46   0.76800  1.0 3.0
   37    33    49    50   0.15000  1.0 3.0
   37    33    49    52   0.31000  1.0 1.0
   37    33    49    52   0.14700 -1.0 2.0
   37    33    49    52   0.07550  1.0 3.0
   37    33    38    39   0.15000  1.0 3.0
   37    33    38    40   0.15000  1.0 3.0
   37    33    38    41   0.15000  1.0 3.0
   37    42    46    47   2.67200 -1.0 2.0
   37    42   -46    49   0.67100  1.0 1.0
   37    42   -46    49   1.42150 -1.0 2.0
   37    42   -46    49   0.18700  1.0 3.0
   37    44    48    51   0.69550 -1.0 2.0
   37    44    48    66   1.09650  1.0 1.0
   37    44    48    66   0.48950 -1.0 2.0
   37    44    48    66   0.49400  1.0 3.0
   42    37    44    45   7.00000 -1.0 2.0
   42    37    44    48   7.00000 -1.0 2.0
   42    46   -49    33   1.39750  1.0 1.0
   42    46   -49    33  -0.07950 -1.0 2.0
   42    46   -49    33  -0.18750  1.0 3.0
   42    46    49    50   0.00000  1.0 1.0
   42    46    49    52   0.00000  1.0 1.0
   43    42    46    47   2.45000 -1.0 2.0
   43    42    46    49   2.45000 -1.0 2.0
   46    49    52    53   0.00000  1.0 1.0
   46    49    52    59  -0.51250  1.0 1.0
   46    49    52    59  -0.88800 -1.0 2.0
   46    49    52    59   0.08850  1.0 3.0
   47    46    49    33   0.30150 -1.0 2.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    52   0.30150 -1.0 2.0
   49    33   -37    42  -0.93550  1.0 1.0
   49    33   -37    42   0.38900 -1.0 2.0
   49    33   -37    42   0.16950  1.0 3.0
   49    33    37    44   0.09850  1.0 1.0
   49    33    37    44   0.15250 -1.0 2.0
   49    33    37    44  -0.50650  1.0 3.0
   49    33    38    39   0.15000  1.0 3.0
   49    33    38    40   0.15000  1.0 3.0
   49    33    38    41   0.15000  1.0 3.0
   49    52    59    60   7.00000 -1.0 2.0
   49    52    59    61   7.00000 -1.0 2.0
   50    49    52    53   0.33100  1.0 3.0
   50    49    52    59   0.00000  1.0 1.0
   53    52    59    60   7.00000 -1.0 2.0
   53    52    59    61   7.00000 -1.0 2.0
   44    37    42    43   0.78350 -1.0 2.0
   44    37    42    46  -0.18900  1.0 1.0
   44    37    42    46   1.70900 -1.0 2.0
   44    48    51    54   0.69550 -1.0 2.0
   44    48    51    55   7.00000 -1.0 2.0
   44    48    66    62   6.00000 -1.0 2.0
   45    44    48    51   0.00000  1.0 1.0
   45    44    48    66   1.00600 -1.0 2.0
   48    51   -54    62   7.00000 -1.0 2.0
   48    51    54    63   7.00000 -1.0 2.0
   48    51    55    56   0.00000  1.0 1.0
   48    51    55    57   0.00000  1.0 1.0
   48    51    55    58   0.00000  1.0 1.0
   51    48   -66    62   6.00000 -1.0 2.0
   51    54   -62    66  -0.18600  1.0 3.0
   51    54    62    67   0.28850  1.0 1.0
   51    54    62    67   2.61350 -1.0 2.0
   51    54    62    67   0.78400  1.0 3.0
   51    54    63    64   0.00000  1.0 1.0
   51    54    63    65   0.00000  1.0 1.0
   51    54    63    69   0.09850  1.0 1.0
   51    54    63    69   0.15250 -1.0 2.0
   51    54    63    69  -0.50650  1.0 3.0
   54    51    55    56   0.00000  1.0 1.0
   54    51    55    57   0.00000  1.0 1.0
   54    51    55    58   0.00000  1.0 1.0
   54    62   -66    48   1.00000 -1.0 2.0
   54    62    67    68   7.00000 -1.0 2.0
   54    62    67    72   7.00000 -1.0 2.0
   54    63    69    70   0.15000  1.0 3.0
   54    63    69    71   0.15000  1.0 3.0
   54    63    69    73  -0.98800  1.0 1.0
   54    63    69    73   0.48800 -1.0 2.0
   54    63    69    73   0.76800  1.0 3.0
   62    54    63    64   0.00000  1.0 1.0
   62    54    63    65   0.00000  1.0 1.0
   62    54    63    69   0.98200  1.0 1.0
   62    54    63    69  -0.11900 -1.0 2.0
   62    54    63    69   0.24250  1.0 3.0
   62    67    72    76   0.15800  1.0 1.0
   62    67    72    76   1.85350 -1.0 2.0
   62    67    72    76  -0.48700  1.0 3.0
   62    67    72    89   0.11450  1.0 1.0
   62    67    72    89   1.85100 -1.0 2.0
   62    67    72    89  -0.49050  1.0 3.0
   66    48   -51    54   1.09650  1.0 1.0
   66    48   -51    54   0.48950 -1.0 2.0
   66    48   -51    54   0.49400  1.0 3.0
   66    48    51    55   7.00000 -1.0 2.0
   66    62    67    68   7.00000 -1.0 2.0
   66    62    67    72   7.00000 -1.0 2.0
   67    62    66    48   1.00000 -1.0 2.0
   67    72    76    77   3.62500 -1.0 2.0
   67    72    76    78   3.62500 -1.0 2.0
   67    72    89    81   3.62500 -1.0 2.0
   67    72    89    90   2.00000 -1.0 2.0
   68    67    72    76   0.56550  1.0 3.0
   68    67    72    89   0.54250  1.0 3.0
   72    76   -77    81   3.62500 -1.0 2.0
   72    76    77    82   3.62500 -1.0 2.0
   72    76    78    79   0.00000  1.0 1.0
   72    76    78    80   0.00000  1.0 1.0
   72    76    78    86   0.04150 -1.0 2.0
   76    72   -89    81   3.62500 -1.0 2.0
   76    72    89    90   2.00000 -1.0 2.0
   76    77   -81    89   3.62500 -1.0 2.0
   76    77    81    91   3.62500 -1.0 2.0
   76    77    82    83   0.00000  1.0 1.0
   76    77    82    84   0.00000  1.0 1.0
   76    77    82    85   0.00000  1.0 1.0
   76    78    86    87   0.43200  1.0 3.0
   76    78    86    88   0.43200  1.0 3.0
   76    78    86    93  -2.95950  1.0 1.0
   76    78    86    93   0.02300  1.0 3.0
   77    76    78    79   0.00000  1.0 1.0
   77    76    78    80   0.00000  1.0 1.0
   77    76    78    86   0.04150 -1.0 2.0
   77    81   -89    72   3.62500 -1.0 2.0
   77    81    89    90   2.00000 -1.0 2.0
   77    81    91    92   0.56550  1.0 3.0
   77    81    91    96   0.15800  1.0 1.0
   77    81    91    96   1.85350 -1.0 2.0
   77    81    91    96  -0.48700  1.0 3.0
   81    77    82    83   0.00000  1.0 1.0
   81    77    82    84   0.00000  1.0 1.0
   81    77    82    85   0.00000  1.0 1.0
   81    91    96    97   7.00000 -1.0 2.0
   81    91    96   112   7.00000 -1.0 2.0
   89    72   -76    77   3.62500 -1.0 2.0
   89    72    76    78   3.62500 -1.0 2.0
   89    81    91    92   0.54250  1.0 3.0
   89    81    91    96   0.11450  1.0 1.0
   89    81    91    96   1.85100 -1.0 2.0
   89    81    91    96  -0.49050  1.0 3.0
   91    81    89    72   3.62500 -1.0 2.0
   91    81    89    90   2.00000 -1.0 2.0
   91    96    97    98  -0.18600  1.0 3.0
   91    96    97   100   0.28850  1.0 1.0
   91    96    97   100   2.61350 -1.0 2.0
   91    96    97   100   0.78400  1.0 3.0
   91    96   112   102  -0.18900  1.0 1.0
   91    96   112   102   1.70900 -1.0 2.0
   91    96   112   113   0.78350 -1.0 2.0
   92    91    96    97   7.00000 -1.0 2.0
   92    91    96   112   7.00000 -1.0 2.0
   96    97    98    99   0.00000  1.0 1.0
   96    97   -98   102  -0.51250  1.0 1.0
   96    97   -98   102  -0.88800 -1.0 2.0
   96    97   -98   102   0.08850  1.0 3.0
   96    97    98   104   0.98200  1.0 1.0
   96    97    98   104  -0.11900 -1.0 2.0
   96    97    98   104   0.24250  1.0 3.0
   96    97   100   101   7.00000 -1.0 2.0
   96    97   100   108   7.00000 -1.0 2.0
   97    96  -112   102  -0.18900  1.0 1.0
   97    96  -112   102   1.70900 -1.0 2.0
   97    96   112   113   0.78350 -1.0 2.0
   97    98   102   103   0.30150 -1.0 2.0
   97    98  -102   112   0.00000  1.0 1.0
   97    98   104   105   0.15000  1.0 3.0
   97    98   104   106   0.15000  1.0 3.0
   97    98   104   107   0.15000  1.0 3.0
   97   100   108   109   0.00000  1.0 1.0
   97   100   108   110   0.00000  1.0 1.0
   97   100   108   111   0.00000  1.0 1.0
   98    97   100   101   7.00000 -1.0 2.0
   98    97   100   108   7.00000 -1.0 2.0
   98   102  -112    96   0.67100  1.0 1.0
   98   102  -112    96   1.42150 -1.0 2.0
   98   102  -112    96   0.18700  1.0 3.0
   98   102   112   113   2.45000 -1.0 2.0
   99    98   102   103   0.00000  1.0 1.0
   99    98   102   112   0.00000  1.0 1.0
   99    98   104   105   0.15000  1.0 3.0
   99    98   104   106   0.15000  1.0 3.0
   99    98   104   107   0.15000  1.0 3.0
  102    98   104   105  -0.11250  1.0 3.0
  102    98   104   106  -0.11250  1.0 3.0
  102    98   104   107  -0.11250  1.0 3.0
  103   102   112    96   2.67200 -1.0 2.0
  103   102   112   113   2.45000 -1.0 2.0
  112    96   -97    98   1.08500 -1.0 2.0
  112    96    97   100  -0.18600  1.0 3.0
  104    98   102   103   0.30150 -1.0 2.0
  104    98   102   112   1.39750  1.0 1.0
  104    98   102   112  -0.07950 -1.0 2.0
  104    98   102   112  -0.18750  1.0 3.0
  100    97    98    99   0.00000  1.0 1.0
  100    97    98   102  -0.51250  1.0 1.0
  100    97    98   102  -0.88800 -1.0 2.0
  100    97    98   102   0.08850  1.0 3.0
  100    97    98   104   0.09850  1.0 1.0
  100    97    98   104   0.15250 -1.0 2.0
  100    97    98   104  -0.50650  1.0 3.0
  101   100   108   109   0.33100  1.0 3.0
  101   100   108   110   0.33100  1.0 3.0
  101   100   108   111   0.33100  1.0 3.0
   82    77    81    89   3.62500 -1.0 2.0
   82    77    81    91   3.62500 -1.0 2.0
   78    76    77    81   3.62500 -1.0 2.0
   78    76    77    82   3.62500 -1.0 2.0
   78    86    93    94   0.41150 -1.0 2.0
   78    86    93    95   0.41150 -1.0 2.0
   79    78    86    87   0.15000  1.0 3.0
   79    78    86    88   0.15000  1.0 3.0
   79    78    86    93  -0.11250  1.0 3.0
   80    78    86    87   0.15000  1.0 3.0
   80    78    86    88   0.15000  1.0 3.0
   80    78    86    93  -0.11250  1.0 3.0
   87    86    93    94   0.00000  1.0 1.0
   87    86    93    95   0.00000  1.0 1.0
   88    86    93    94   0.00000  1.0 1.0
   88    86    93    95   0.00000  1.0 1.0
   63    54    62    66   1.08500 -1.0 2.0
   63    54    62    67  -0.18600  1.0 3.0
   63    69    73    74   0.41150 -1.0 2.0
   63    69    73    75   0.41150 -1.0 2.0
   64    63    69    70   0.15000  1.0 3.0
   64    63    69    71   0.15000  1.0 3.0
   64    63    69    73  -0.11250  1.0 3.0
   65    63    69    70   0.15000  1.0 3.0
   65    63    69    71   0.15000  1.0 3.0
   65    63    69    73  -0.11250  1.0 3.0
   70    69    73    74   0.00000  1.0 1.0
   70    69    73    75   0.00000  1.0 1.0
   71    69    73    74   0.00000  1.0 1.0
   71    69    73    75   0.00000  1.0 1.0
   55    51    54    62   7.00000 -1.0 2.0
   55    51    54    63   7.00000 -1.0 2.0
   38    33    37    42  -0.93550  1.0 1.0
   38    33    37    42   0.38900 -1.0 2.0
   38    33    37    42   0.16950  1.0 3.0
   38    33    37    44   0.09850  1.0 1.0
   38    33    37    44   0.15250 -1.0 2.0
   38    33    37    44  -0.50650  1.0 3.0
   38    33    49    46  -0.95700  1.0 1.0
   38    33    49    46  -0.18200 -1.0 2.0
   38    33    49    46   0.29450  1.0 3.0
   38    33    49    50   0.15000  1.0 3.0
   38    33    49    52   0.34400  1.0 1.0
   38    33    49    52   0.09450 -1.0 2.0
   38    33    49    52   0.11100  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    44   1.10000 -1.0 2.0
   43    46    42    37   1.00000 -1.0 2.0
   42    49    46    47  10.50000 -1.0 2.0
   49    53    52    59  15.00000 -1.0 2.0
   60    61    59    52  15.00000 -1.0 2.0
   48    45    44    37   1.10000 -1.0 2.0
   44    51    48    66  10.50000 -1.0 2.0
   48    55    51    54   1.10000 -1.0 2.0
   62    63    54    51   1.10000 -1.0 2.0
   54    66    62    67   1.10000 -1.0 2.0
   72    68    67    62   1.10000 -1.0 2.0
   76    89    72    67   4.00000 -1.0 2.0
   77    78    76    72   4.00000 -1.0 2.0
   81    82    77    76   4.00000 -1.0 2.0
   91    89    81    77   4.00000 -1.0 2.0
   90    72    89    81   1.00000 -1.0 2.0
   81    92    91    96   1.10000 -1.0 2.0
   97   112    96    91   1.10000 -1.0 2.0
   96    98    97   100   1.10000 -1.0 2.0
   98   112   102   103  10.50000 -1.0 2.0
  113   102   112    96   1.00000 -1.0 2.0
  108   101   100    97   1.10000 -1.0 2.0
   94    86    93    95  10.50000 -1.0 2.0
   74    69    73    75  10.50000 -1.0 2.0
END
