* LIGAND DATABASE FILE (OPLS2005)
*
001     108   108    194    289     566
    1     0 S   NP   _N1_     1    28.84748    94.41415   -20.27257
    2     1 S   H    _HN1     2     1.02784    84.77301   -65.50436
    3     1 S   H    _H1_     3     1.02961    95.52654    42.43183
    4     1 S   H    _H2_     4     1.02843    31.29927   156.50566
    5     1 S   CT   _CA1     5     1.50088   141.03034   175.09236
    6     5 S   HC   _HA1     6     1.09576   105.27412    48.91075
    7     5 S   CO3  _C1_     7     1.53879   112.35904   -71.31915
    8     7 S   O2Z  _O11     8     1.26339   115.02513   -45.60303
    9     7 S   O2Z  _O12     9     1.26248   114.94575   133.68513
   10     5 S   CT   _CB1    10     1.53137   107.44049   166.78939
   11    10 S   HC   HB11    11     1.09809   109.52255   -51.25404
   12    10 S   HC   HB12    12     1.09824   110.36374    65.39471
   13    10 S   CT   _CG1    13     1.52920   112.46512  -172.41511
   14    13 S   HC   HG11    14     1.09486   110.02048   -60.00784
   15    13 S   HC   HG12    15     1.09619   110.23996    59.07783
   16    13 S   C    _CD1    16     1.51750   112.48125   179.67434
   17    16 S   O    _OE1    17     1.22701   123.24908   -11.94253
   18    16 S   N    _N2_    18     1.38563   111.48028   168.47744
   19    18 S   H    _HN2    19     1.01580   118.92898     1.86109
   20    18 S   CT1  _CA2    20     1.46243   123.74987  -176.39429
   21    20 S   HC   _HA2    21     1.09732   109.29339   -18.46618
   22    20 S   C    _C2_    22     1.53426   108.29065  -134.17314
   23    22 S   O    _O2_    23     1.23001   122.33394  -146.94154
   24    20 S   CT   _CB2    32     1.53515   111.01764   103.76363
   25    24 S   HC   HB21    33     1.09520   109.53810    52.11891
   26    24 S   HC   HB22    34     1.09490   110.81784   170.80764
   27    22 S   N    _N3_    24     1.38547   113.29821    40.61407
   28    27 S   H    _HN3    25     1.01533   118.87310    -0.64650
   29    24 S   S    _SG2    35     1.83032   111.39815   -70.20413
   30    27 S   CT   _CA3    26     1.45451   123.47920   175.02330
   31    30 S   HC   HA31    27     1.09521   109.25811    23.77168
   32    30 S   HC   HA32    28     1.09496   107.10793   140.78966
   33    29 S   CT   _C11    36     1.87263   100.52448   150.78586
   34    30 S   CO3  _C3_    29     1.52933   113.13656   -99.71692
   35    34 S   O2Z  _O31    30     1.26402   115.42454   -43.47075
   36    34 S   O2Z  _O32    31     1.26358   114.96735   137.47136
   37    33 S   CM   _C10    37     1.53501   107.26980   -74.33169
   38    37 S   HC   _H10    38     1.08636   113.77178   -21.05830
   39    33 S   CT   _C12    54     1.55550   108.55806   167.11814
   40    39 S   HC   _H11    55     1.09912   109.71788   -57.21073
   41    39 S   HC   _H12    56     1.09913   109.03496  -170.81770
   42    33 S   OS   _O35   104     1.43907   110.11028    43.33451
   43    37 S   CMA  _C9_    39     1.35997   127.26263   162.91078
   44    43 S   OM   _O36    40     1.26199   127.76962     0.10835
   45    39 S   CT   _C13    57     1.53396   116.29654    66.05191
   46    45 S   HC   _H13    58     1.09476   111.07376    64.51160
   47    45 S   HC   _H14    59     1.09348   111.71564   -56.61735
   48    42 S   CT   _C30   105     1.41864   117.31360    77.46977
   49    48 S   HC   _H39   106     1.09375   107.91524  -170.19819
   50    48 S   HC   _H40   107     1.09341   110.68421    72.24030
   51    48 S   HC   _H41   108     1.09320   111.82712   -51.38360
   52    43 S   N    _N4_    41     1.42009   119.11005   178.82764
   53    45 S   N    _N5_    60     1.45397   110.93888  -174.96814
   54    53 S   H    _H15    61     1.01509   117.74951    91.36607
   55    52 S   C    _C8_    42     1.41913   126.47788  -165.59277
   56    55 S   O    _O33    43     1.22207   131.53855    -3.05557
   57    53 S   C    _C14    62     1.38600   122.88763   -87.69794
   58    57 S   O    _O34    63     1.22724   125.01389    -0.49099
   59    55 S   CM   _C7_    44     1.47436   107.60867   174.65375
   60    59 S   HC   _H9_    45     1.07591   124.66116  -176.98494
   61    57 S   CT   _C15    64     1.51769   111.71515   179.46624
   62    61 S   HC   _H16    65     1.09725   108.09871   -58.16815
   63    61 S   HC   _H17    66     1.09724   108.13460    58.24333
   64    59 S   CM   _C6_    46     1.33060   107.27381     1.72101
   65    64 S   HC   _H8_    47     1.08167   123.77940  -178.77859
   66    61 S   CT   _C16    67     1.52693   112.31344  -179.84423
   67    66 S   HC   _H18    68     1.09686   109.98598   -58.93768
   68    66 S   HC   _H19    69     1.09716   109.77828    57.84411
   69    52 S   CT   _C5_    48     1.46404   123.94410    13.59856
   70    69 S   HC   _H3_    49     1.09515   110.49705   -58.05167
   71    66 S   CM   _C17    70     1.50045   111.09142  -179.14774
   72    71 S   HC   _H20    71     1.08752   116.67462    63.58272
   73    69 S   CT   _C4_    50     1.52853   113.06854    68.85596
   74    73 S   HC   _H5_    51     1.09670   111.57560    54.33641
   75    73 S   HC   _H6_    52     1.09301   111.73520   -65.31998
   76    73 S   HC   _H7_    53     1.09551   110.93111   174.54907
   77    71 S   CM   _C18    72     1.34163   123.85325  -116.65040
   78    77 S   HC   _H21    73     1.08794   119.34190    -0.17804
   79    77 S   CT   _C19    74     1.50929   123.66498   179.62780
   80    79 S   HC   _H4_    75     1.09739   109.86544    -2.14165
   81    79 S   CT   _C20    76     1.53151   109.29715   115.14089
   82    81 S   HC   _H22    77     1.09600   111.58968    62.07056
   83    81 S   HC   _H23    78     1.09585   111.00872   -58.32865
   84    81 S   HC   _H24    79     1.09542   110.67841  -177.77340
   85    79 S   CT   _C21    80     1.54255   111.82558  -122.94720
   86    85 S   HC   _H25    81     1.09739   109.09177  -176.18951
   87    85 S   HC   _H26    82     1.09876   109.39471   -61.19302
   88    85 S   CT   _C22    83     1.53802   115.44298    60.58111
   89    88 S   HC   _H27    84     1.09702   108.38850   178.61662
   90    88 S   HC   _H28    85     1.09796   108.59215   -67.98221
   91    88 S   CM   _C23    86     1.51837   115.49945    56.51473
   92    91 S   CM   _C24    87     1.34305   119.05050  -118.38810
   93    92 S   Cl   Cl1_    88     1.71219   126.23342  -179.26458
   94    92 S   HC   _H29    89     1.08280   123.10522     0.16313
   95    91 S   CT   _C25    90     1.51581   117.07295    62.13829
   96    95 S   HC   _H30    91     1.09600   109.61520   -48.72450
   97    95 S   HC   _H31    92     1.09586   110.99467  -164.01268
   98    95 S   CT   _C26    93     1.53311   112.39632    73.76886
   99    98 S   HC   _H32    94     1.09664   109.77775   -61.10592
  100    98 S   HC   _H33    95     1.09748   109.39574    56.46339
  101    98 S   CT   _C27    96     1.53347   111.08874   177.78000
  102   101 S   HC   _H34    97     1.09722   108.90692    57.83906
  103   101 S   HC   _H35    98     1.09720   108.97069   -58.12661
  104   101 S   CM   _C28    99     1.50437   116.59452   179.85735
  105   104 S   HC   _H36   100     1.08862   115.12151  -179.78971
  106   104 S   CM   _C29   101     1.33828   127.50622     0.23239
  107   106 S   HC   _H37   102     1.08524   120.15299   180.00000
  108   106 S   HC   _H38   103     1.08352   122.51335     0.00000
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  17   2   1   1  12   5  11   6   5   6   9   3   7   4   3   3
   2   1   1  12   7   3   8   4   8   4   6   3   8   5   4   7
   3   7   4   3   5   4   7   3   3   2   1   1  11   4  12   8
   7   3   2   1   8   5   4  10   4   3  10   6   2   1   9   5
   4   8   5   4   7   4   3   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    42    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    39    40    41    45    42    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    43    44    52    39    40    41    45    46    47    53    42    48    49    50    51  
   35    36  
   36  
    0  
   38    43    44    52    55    69    39    40    41    45    42    48  
   43    44    52    39    42  
   40    41    45    46    47    53    54    57    42    48    43  
   41    45    46    47    53    42  
   45    46    47    53    42  
   48    49    50    51    43    45  
   44    52    55    56    59    64    69    70    73  
   52    55    69  
   46    47    53    54    57    58    61  
   47    53    54    57  
   53    54    57  
   49    50    51  
   50    51  
   51  
    0  
   55    56    59    60    64    65    69    70    73    74    75    76  
   54    57    58    61    62    63    66  
   57    58    61  
   56    59    60    64    65    69    70    73  
   59    60    64    69  
   58    61    62    63    66    67    68    71  
   61    62    63    66  
   60    64    65    69    70    73  
   64    65    69  
   62    63    66    67    68    71    72    77  
   63    66    67    68    71  
   66    67    68    71  
   65    69    70    73    74    75    76  
   69    70    73  
   67    68    71    72    77    78    79  
   68    71    72    77  
   71    72    77  
   70    73    74    75    76  
   73    74    75    76  
   72    77    78    79    80    81    85  
   77    78    79  
   74    75    76  
   75    76  
   76  
    0  
   78    79    80    81    82    83    84    85    86    87    88  
   79    80    81    85  
   80    81    82    83    84    85    86    87    88    89    90    91  
   81    82    83    84    85    86    87    88  
   82    83    84    85    86    87    88  
   83    84    85  
   84    85  
   85  
   86    87    88    89    90    91    92    95  
   87    88    89    90    91  
   88    89    90    91  
   89    90    91    92    93    94    95    96    97    98  
   90    91    92    95  
   91    92    95  
   92    93    94    95    96    97    98    99   100   101  
   93    94    95    96    97    98  
   94    95  
   95  
   96    97    98    99   100   101   102   103   104  
   97    98    99   100   101  
   98    99   100   101  
   99   100   101   102   103   104   105   106  
  100   101   102   103   104  
  101   102   103   104  
  102   103   104   105   106   107   108  
  103   104   105   106  
  104   105   106  
  105   106   107   108  
  106   107   108  
  107   108  
  108  
    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   0.417900   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  -0.785200   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.9000   0.1400  -0.400000   1.5900   1.4000   0.020110767  -0.896042159
   43   3.5500   0.0760   0.497600   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   48   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   52   3.2500   0.1700  -0.592500   1.8100   1.6000   0.054801302  -1.445846770
   53   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   54   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   55   3.7500   0.1050   0.556700   1.9250   1.7000   0.001000000  -0.126889456
   56   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   57   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   59   3.5500   0.0760  -0.171700   2.0020   1.7750   0.023028004  -0.852763146
   60   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660   0.010000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   71   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   72   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   77   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   78   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   79   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   82   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   92   3.5500   0.0760   0.005000   2.0020   1.7750   0.023028004  -0.852763146
   93   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   94   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   95   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   98   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  101   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  104   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
  105   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  107   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  108   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   317.000  1.510
   33    39   268.000  1.529
   33    42   320.000  1.410
   37    38   340.000  1.080
   37    43   465.000  1.376
   43    44   745.000  1.250
   43    52   400.000  1.384
   52    55   490.000  1.335
   52    69   337.000  1.449
   55    56   570.000  1.229
   55    59   410.000  1.444
   59    60   340.000  1.080
   59    64   549.000  1.340
   64    65   340.000  1.080
   64    69   317.000  1.510
   69    70   340.000  1.090
   69    73   268.000  1.529
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    53   337.000  1.449
   53    54   434.000  1.010
   53    57   490.000  1.335
   57    58   570.000  1.229
   57    61   317.000  1.522
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    66   268.000  1.529
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    71   317.000  1.510
   71    72   340.000  1.080
   71    77   549.000  1.340
   77    78   340.000  1.080
   77    79   317.000  1.510
   79    80   340.000  1.090
   79    81   268.000  1.529
   79    85   268.000  1.529
   81    82   340.000  1.090
   81    83   340.000  1.090
   81    84   340.000  1.090
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   317.000  1.510
   91    92   549.000  1.340
   91    95   317.000  1.510
   92    93   300.000  1.725
   92    94   340.000  1.080
   95    96   340.000  1.090
   95    97   340.000  1.090
   95    98   268.000  1.529
   98    99   340.000  1.090
   98   100   340.000  1.090
   98   101   268.000  1.529
  101   102   340.000  1.090
  101   103   340.000  1.090
  101   104   317.000  1.510
  104   105   340.000  1.080
  104   106   549.000  1.340
  106   107   340.000  1.080
  106   108   340.000  1.080
   42    48   320.000  1.410
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    51   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    39    75.00000  111.63000
   29    33    42    85.00000  114.68000
   33    37    38    35.00000  117.00000
   33    37    43    70.00000  124.00000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    45    58.35000  112.70000
   33    42    48    60.00000  109.50000
   37    43    44    65.00000  137.10300
   37    43    52    75.00000  120.83300
   43    37    38    40.00000  120.50800
   43    52    55    70.00000  120.89900
   43    52    69    70.00000  119.94800
   52    43    44   110.00000  107.01400
   52    55    56    80.00000  122.90000
   52    55    59    80.00000  111.56200
   52    69    64    75.00000  110.78400
   52    69    70    35.00000  109.50000
   52    69    73    70.00000  110.72300
   55    59    60    35.00000  119.70000
   55    59    64    70.00000  118.70000
   59    55    56    80.00000  125.30000
   59    64    65    35.00000  120.00000
   59    64    69    70.00000  124.00000
   64    59    60    35.00000  120.00000
   64    69    70    35.00000  109.50000
   64    69    73    70.00000  112.02700
   69    52    55    50.00000  121.90000
   69    64    65    35.00000  117.00000
   69    73    74    37.50000  110.70000
   69    73    75    37.50000  110.70000
   69    73    76    37.50000  110.70000
   73    69    70    37.50000  110.70000
   75    73    74    33.00000  107.80000
   76    73    74    33.00000  107.80000
   76    73    75    33.00000  107.80000
   39    33    37    70.00000  112.02700
   39    45    46    37.50000  110.70000
   39    45    47    37.50000  110.70000
   39    45    53    70.00000  110.72300
   41    39    40    33.00000  107.80000
   45    39    40    37.50000  110.70000
   45    39    41    37.50000  110.70000
   45    53    54    38.00000  118.40000
   45    53    57    50.00000  121.90000
   47    45    46    33.00000  107.80000
   53    45    46    35.00000  109.50000
   53    45    47    35.00000  109.50000
   53    57    58    80.00000  122.90000
   53    57    61    70.00000  116.60000
   57    53    54    35.00000  119.80000
   57    61    62    35.00000  109.50000
   57    61    63    35.00000  109.50000
   57    61    66    63.00000  111.10000
   61    57    58    80.00000  120.40000
   61    66    67    37.50000  110.70000
   61    66    68    37.50000  110.70000
   61    66    71    70.00000  112.02700
   63    61    62    33.00000  107.80000
   66    61    62    37.50000  110.70000
   66    61    63    37.50000  110.70000
   66    71    72    35.00000  117.00000
   66    71    77    70.00000  124.00000
   68    66    67    33.00000  107.80000
   71    66    67    35.00000  109.50000
   71    66    68    35.00000  109.50000
   71    77    78    35.00000  120.00000
   71    77    79    70.00000  124.00000
   77    71    72    35.00000  120.00000
   77    79    80    35.00000  109.50000
   77    79    81    70.00000  112.02700
   77    79    85    70.00000  112.02700
   79    77    78    35.00000  117.00000
   79    81    82    37.50000  110.70000
   79    81    83    37.50000  110.70000
   79    81    84    37.50000  110.70000
   79    85    86    37.50000  110.70000
   79    85    87    37.50000  110.70000
   79    85    88    58.35000  112.70000
   81    79    80    37.50000  110.70000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   85    79    80    37.50000  110.70000
   85    79    81    58.35000  112.70000
   85    88    89    37.50000  110.70000
   85    88    90    37.50000  110.70000
   85    88    91    70.00000  112.02700
   87    85    86    33.00000  107.80000
   88    85    86    37.50000  110.70000
   88    85    87    37.50000  110.70000
   88    91    92    70.00000  124.00000
   88    91    95    65.00000  117.92700
   90    88    89    33.00000  107.80000
   91    88    89    35.00000  109.50000
   91    88    90    35.00000  109.50000
   91    92    93    75.00000  121.50000
   91    92    94    35.00000  120.00000
   91    95    96    35.00000  109.50000
   91    95    97    35.00000  109.50000
   91    95    98    70.00000  112.02700
   94    92    93    60.00000  114.00000
   95    91    92    70.00000  124.00000
   95    98    99    37.50000  110.70000
   95    98   100    37.50000  110.70000
   95    98   101    58.35000  112.70000
   97    95    96    33.00000  107.80000
   98    95    96    37.50000  110.70000
   98    95    97    37.50000  110.70000
   98   101   102    37.50000  110.70000
   98   101   103    37.50000  110.70000
   98   101   104    70.00000  112.02700
  100    98    99    33.00000  107.80000
  101    98    99    37.50000  110.70000
  101    98   100    37.50000  110.70000
  101   104   105    35.00000  117.00000
  101   104   106    70.00000  124.00000
  103   101   102    33.00000  107.80000
  104   101   102    35.00000  109.50000
  104   101   103    35.00000  109.50000
  104   106   107    35.00000  120.00000
  104   106   108    35.00000  120.00000
  106   104   105    35.00000  120.00000
  108   106   107    35.00000  117.00000
   42    33    37    85.00000  110.90400
   42    33    39    50.00000  109.50000
   42    48    49    35.00000  109.50000
   42    48    50    35.00000  109.50000
   42    48    51    35.00000  109.50000
   50    48    49    33.00000  107.80000
   51    48    49    33.00000  107.80000
   51    48    50    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    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   24    29    33    42   0.13850  1.0 1.0
   24    29    33    42  -1.34450 -1.0 2.0
   24    29    33    42   0.57400  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.00000  1.0 1.0
   29    33    37    43   0.42700  1.0 1.0
   29    33    37    43  -0.70350 -1.0 2.0
   29    33    37    43  -0.43150  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    45   0.44750  1.0 1.0
   29    33    39    45  -0.17800 -1.0 2.0
   29    33    39    45   0.20200  1.0 3.0
   29    33    42    48   0.14700  1.0 1.0
   29    33    42    48  -1.16150 -1.0 2.0
   29    33    42    48   0.48700  1.0 3.0
   33    37    43    44   7.00000 -1.0 2.0
   33    37    43    52   7.00000 -1.0 2.0
   33    39    45    46   0.15000  1.0 3.0
   33    39    45    47   0.15000  1.0 3.0
   33    39    45    53   0.43900  1.0 1.0
   33    39    45    53   0.49100 -1.0 2.0
   33    39    45    53   0.28400  1.0 3.0
   33    42    48    49   0.37050  1.0 3.0
   33    42    48    50   0.37050  1.0 3.0
   33    42    48    51   0.37050  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    45   0.34400  1.0 1.0
   37    33    39    45   0.09450 -1.0 2.0
   37    33    39    45   0.11100  1.0 3.0
   37    33    42    48  -0.77900  1.0 1.0
   37    33    42    48  -0.36900 -1.0 2.0
   37    33    42    48   0.40400  1.0 3.0
   37    43    52    55  -0.18900  1.0 1.0
   37    43    52    55   1.70900 -1.0 2.0
   37    43    52    69  -0.88150  1.0 1.0
   37    43    52    69   2.95600 -1.0 2.0
   38    37    43    44   7.00000 -1.0 2.0
   38    37    43    52   7.00000 -1.0 2.0
   43    52    55    56   2.67200 -1.0 2.0
   43    52    55    59   2.45000 -1.0 2.0
   43    52    69    64   0.17850 -1.0 2.0
   43    52    69    70   0.00000  1.0 1.0
   43    52    69    73  -0.05900 -1.0 2.0
   44    43    52    55  -0.56400  1.0 1.0
   44    43    52    55   0.77500 -1.0 2.0
   44    43    52    55   0.18700  1.0 3.0
   44    43    52    69   1.00000 -1.0 2.0
   52    55    59    60   0.65100 -1.0 2.0
   52    55   -59    64   0.49500  1.0 1.0
   52    55   -59    64   1.31600 -1.0 2.0
   52    55   -59    64  -0.02300  1.0 3.0
   52    69    73    74   0.15000  1.0 3.0
   52    69    73    75   0.15000  1.0 3.0
   52    69    73    76   0.15000  1.0 3.0
   55    52   -69    64  -0.19250  1.0 1.0
   55    52   -69    64  -0.00500 -1.0 2.0
   55    52   -69    64   0.17000  1.0 3.0
   55    52    69    70   0.00000  1.0 1.0
   55    52    69    73  -0.43950  1.0 1.0
   55    52    69    73  -0.08100 -1.0 2.0
   55    52    69    73   0.03350  1.0 3.0
   55    59    64    65   7.00000 -1.0 2.0
   55    59   -64    69   7.00000 -1.0 2.0
   56    55    59    60   0.00000  1.0 1.0
   56    55    59    64   1.00000 -1.0 2.0
   59    64   -69    52   0.62150  1.0 1.0
   59    64   -69    52   0.42850 -1.0 2.0
   59    64   -69    52  -0.68200  1.0 3.0
   59    64    69    70   0.00000  1.0 1.0
   59    64    69    73   0.09850  1.0 1.0
   59    64    69    73   0.15250 -1.0 2.0
   59    64    69    73  -0.50650  1.0 3.0
   60    59    64    65   7.00000 -1.0 2.0
   60    59    64    69   7.00000 -1.0 2.0
   64    69    73    74   0.15000  1.0 3.0
   64    69    73    75   0.15000  1.0 3.0
   64    69    73    76   0.15000  1.0 3.0
   65    64    69    52   0.00000  1.0 1.0
   65    64    69    70   0.33100  1.0 3.0
   65    64    69    73   0.00000  1.0 1.0
   69    52    55    56   3.04450 -1.0 2.0
   69    52   -55    59   1.49850  1.0 1.0
   69    52   -55    59   1.53950 -1.0 2.0
   70    69    73    74   0.15000  1.0 3.0
   70    69    73    75   0.15000  1.0 3.0
   70    69    73    76   0.15000  1.0 3.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    43   0.09850  1.0 1.0
   39    33    37    43   0.15250 -1.0 2.0
   39    33    37    43  -0.50650  1.0 3.0
   39    33    42    48   0.06250  1.0 1.0
   39    33    42    48  -0.01100 -1.0 2.0
   39    33    42    48   0.28050  1.0 3.0
   39    45    53    54   0.00000  1.0 1.0
   39    45    53    57  -0.43950  1.0 1.0
   39    45    53    57  -0.08100 -1.0 2.0
   39    45    53    57   0.03350  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
   41    39    45    46   0.15000  1.0 3.0
   41    39    45    47   0.15000  1.0 3.0
   41    39    45    53   0.15000  1.0 3.0
   45    53    57    58   3.04450 -1.0 2.0
   45    53    57    61   1.49850  1.0 1.0
   45    53    57    61   1.53950 -1.0 2.0
   46    45    53    54   0.00000  1.0 1.0
   46    45    53    57   0.00000  1.0 1.0
   47    45    53    54   0.00000  1.0 1.0
   47    45    53    57   0.00000  1.0 1.0
   53    57    61    62   0.00000  1.0 1.0
   53    57    61    63   0.00000  1.0 1.0
   53    57    61    66   1.39750  1.0 1.0
   53    57    61    66  -0.07950 -1.0 2.0
   53    57    61    66  -0.18750  1.0 3.0
   54    53    57    58   2.45000 -1.0 2.0
   54    53    57    61   2.45000 -1.0 2.0
   57    61    66    67  -0.11250  1.0 3.0
   57    61    66    68  -0.11250  1.0 3.0
   57    61    66    71  -0.98800  1.0 1.0
   57    61    66    71   0.48800 -1.0 2.0
   57    61    66    71   0.76800  1.0 3.0
   58    57    61    62   0.00000  1.0 1.0
   58    57    61    63   0.00000  1.0 1.0
   58    57    61    66   0.30150 -1.0 2.0
   61    66    71    72   0.00000  1.0 1.0
   61    66    71    77   0.09850  1.0 1.0
   61    66    71    77   0.15250 -1.0 2.0
   61    66    71    77  -0.50650  1.0 3.0
   62    61    66    67   0.15000  1.0 3.0
   62    61    66    68   0.15000  1.0 3.0
   62    61    66    71   0.15000  1.0 3.0
   63    61    66    67   0.15000  1.0 3.0
   63    61    66    68   0.15000  1.0 3.0
   63    61    66    71   0.15000  1.0 3.0
   66    71    77    78   7.00000 -1.0 2.0
   66    71    77    79   7.00000 -1.0 2.0
   67    66    71    72   0.33100  1.0 3.0
   67    66    71    77   0.00000  1.0 1.0
   68    66    71    72   0.33100  1.0 3.0
   68    66    71    77   0.00000  1.0 1.0
   71    77    79    80   0.00000  1.0 1.0
   71    77    79    81   0.09850  1.0 1.0
   71    77    79    81   0.15250 -1.0 2.0
   71    77    79    81  -0.50650  1.0 3.0
   71    77    79    85   0.09850  1.0 1.0
   71    77    79    85   0.15250 -1.0 2.0
   71    77    79    85  -0.50650  1.0 3.0
   72    71    77    78   7.00000 -1.0 2.0
   72    71    77    79   7.00000 -1.0 2.0
   77    79    81    82   0.15000  1.0 3.0
   77    79    81    83   0.15000  1.0 3.0
   77    79    81    84   0.15000  1.0 3.0
   77    79    85    86   0.15000  1.0 3.0
   77    79    85    87   0.15000  1.0 3.0
   77    79    85    88   0.34400  1.0 1.0
   77    79    85    88   0.09450 -1.0 2.0
   77    79    85    88   0.11100  1.0 3.0
   78    77    79    80   0.33100  1.0 3.0
   78    77    79    81   0.00000  1.0 1.0
   78    77    79    85   0.00000  1.0 1.0
   79    85    88    89   0.15000  1.0 3.0
   79    85    88    90   0.15000  1.0 3.0
   79    85    88    91   0.34400  1.0 1.0
   79    85    88    91   0.09450 -1.0 2.0
   79    85    88    91   0.11100  1.0 3.0
   80    79    81    82   0.15000  1.0 3.0
   80    79    81    83   0.15000  1.0 3.0
   80    79    81    84   0.15000  1.0 3.0
   80    79    85    86   0.15000  1.0 3.0
   80    79    85    87   0.15000  1.0 3.0
   80    79    85    88   0.15000  1.0 3.0
   81    79    85    86   0.15000  1.0 3.0
   81    79    85    87   0.15000  1.0 3.0
   81    79    85    88   0.56750  1.0 1.0
   81    79    85    88  -0.07550 -1.0 2.0
   81    79    85    88   0.20000  1.0 3.0
   85    79    81    82   0.15000  1.0 3.0
   85    79    81    83   0.15000  1.0 3.0
   85    79    81    84   0.15000  1.0 3.0
   85    88    91    92   0.09850  1.0 1.0
   85    88    91    92   0.15250 -1.0 2.0
   85    88    91    92  -0.50650  1.0 3.0
   85    88    91    95   0.46850  1.0 1.0
   85    88    91    95   0.08550 -1.0 2.0
   85    88    91    95   0.09800  1.0 3.0
   86    85    88    89   0.15000  1.0 3.0
   86    85    88    90   0.15000  1.0 3.0
   86    85    88    91   0.15000  1.0 3.0
   87    85    88    89   0.15000  1.0 3.0
   87    85    88    90   0.15000  1.0 3.0
   87    85    88    91   0.15000  1.0 3.0
   88    91    92    93   7.00000 -1.0 2.0
   88    91    92    94   7.00000 -1.0 2.0
   88    91    95    96   0.34800  1.0 3.0
   88    91    95    97   0.34800  1.0 3.0
   88    91    95    98   0.46850  1.0 1.0
   88    91    95    98   0.08550 -1.0 2.0
   88    91    95    98   0.09800  1.0 3.0
   89    88    91    92   0.00000  1.0 1.0
   89    88    91    95   0.34800  1.0 3.0
   90    88    91    92   0.00000  1.0 1.0
   90    88    91    95   0.34800  1.0 3.0
   91    95    98    99   0.15000  1.0 3.0
   91    95    98   100   0.15000  1.0 3.0
   91    95    98   101   0.34400  1.0 1.0
   91    95    98   101   0.09450 -1.0 2.0
   91    95    98   101   0.11100  1.0 3.0
   92    91    95    96   0.00000  1.0 1.0
   92    91    95    97   0.00000  1.0 1.0
   92    91    95    98   0.09850  1.0 1.0
   92    91    95    98   0.15250 -1.0 2.0
   92    91    95    98  -0.50650  1.0 3.0
   95    91    92    93   7.00000 -1.0 2.0
   95    91    92    94   7.00000 -1.0 2.0
   95    98   101   102   0.15000  1.0 3.0
   95    98   101   103   0.15000  1.0 3.0
   95    98   101   104   0.34400  1.0 1.0
   95    98   101   104   0.09450 -1.0 2.0
   95    98   101   104   0.11100  1.0 3.0
   96    95    98    99   0.15000  1.0 3.0
   96    95    98   100   0.15000  1.0 3.0
   96    95    98   101   0.15000  1.0 3.0
   97    95    98    99   0.15000  1.0 3.0
   97    95    98   100   0.15000  1.0 3.0
   97    95    98   101   0.15000  1.0 3.0
   98   101   104   105   0.00000  1.0 1.0
   98   101   104   106   0.09850  1.0 1.0
   98   101   104   106   0.15250 -1.0 2.0
   98   101   104   106  -0.50650  1.0 3.0
   99    98   101   102   0.15000  1.0 3.0
   99    98   101   103   0.15000  1.0 3.0
   99    98   101   104   0.15000  1.0 3.0
  100    98   101   102   0.15000  1.0 3.0
  100    98   101   103   0.15000  1.0 3.0
  100    98   101   104   0.15000  1.0 3.0
  101   104   106   107   7.00000 -1.0 2.0
  101   104   106   108   7.00000 -1.0 2.0
  102   101   104   105   0.33100  1.0 3.0
  102   101   104   106   0.00000  1.0 1.0
  103   101   104   105   0.33100  1.0 3.0
  103   101   104   106   0.00000  1.0 1.0
  105   104   106   107   7.00000 -1.0 2.0
  105   104   106   108   7.00000 -1.0 2.0
   42    33    37    38   0.00000  1.0 1.0
   42    33    37    43   0.39000  1.0 1.0
   42    33    37    43  -0.05800 -1.0 2.0
   42    33    37    43  -0.55150  1.0 3.0
   42    33    39    40   0.23400  1.0 3.0
   42    33    39    41   0.23400  1.0 3.0
   42    33    39    45   0.62750  1.0 1.0
   42    33    39    45  -0.30950 -1.0 2.0
   42    33    39    45   0.27300  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    38    37    43  15.00000 -1.0 2.0
   52    44    43    37  15.00000 -1.0 2.0
   69    55    52    43   1.00000 -1.0 2.0
   52    59    55    56  10.50000 -1.0 2.0
   55    60    59    64   1.10000 -1.0 2.0
   69    65    64    59   1.10000 -1.0 2.0
   54    57    53    45   1.00000 -1.0 2.0
   53    61    57    58  10.50000 -1.0 2.0
   66    72    71    77  15.00000 -1.0 2.0
   79    78    77    71  15.00000 -1.0 2.0
   88    95    91    92  15.00000 -1.0 2.0
   93    94    92    91  15.00000 -1.0 2.0
  101   105   104   106  15.00000 -1.0 2.0
  107   108   106   104  15.00000 -1.0 2.0
END
