* LIGAND DATABASE FILE (OPLS2005)
*
001     109   108    194    270     557
    1     0 S   NP   _N1_     1    30.01327    98.98340   -25.58137
    2     1 S   H    _HN1     2     1.02827    55.88899  -178.25381
    3     1 S   H    _H1_     3     1.02779   111.73651   -80.76471
    4     1 S   H    _H2_     4     1.02960    52.40471    16.18622
    5     1 S   CT   _CA1     5     1.50129   135.98777    96.65464
    6     5 S   HC   _HA1     6     1.09586   105.16886   121.00614
    7     5 S   CO3  _C1_     7     1.53803   112.56354     0.98873
    8     7 S   O2Z  _O11     8     1.26364   115.00926   -40.07174
    9     7 S   O2Z  _O12     9     1.26266   114.95195   139.04693
   10     5 S   CT   _CB1    10     1.53098   107.38615  -121.16395
   11    10 S   HC   HB11    11     1.09819   109.19451   -51.19316
   12    10 S   HC   HB12    12     1.09811   110.50741    65.39126
   13    10 S   CT   _CG1    13     1.52901   112.57931  -172.33274
   14    13 S   HC   HG11    14     1.09607   110.42365   -66.66806
   15    13 S   HC   HG12    15     1.09663   109.86840    52.45002
   16    13 S   C    _CD1    16     1.51795   112.60664   172.53097
   17    16 S   O    _OE1    17     1.22676   123.48918    -3.09712
   18    16 S   N    _N2_    18     1.38576   111.31335   177.75947
   19    18 S   H    _HN2    19     1.01455   118.73498     0.91749
   20    18 S   CT1  _CA2    20     1.45989   123.72706   177.14556
   21    20 S   HC   _HA2    21     1.09617   109.21489     3.29942
   22    20 S   C    _C2_    22     1.53651   109.70768  -112.53279
   23    22 S   O    _O2_    23     1.23116   121.86343  -159.30634
   24    20 S   CT   _CB2    32     1.53195   111.25926   125.68097
   25    24 S   HC   HB21    33     1.09529   109.73401    58.73128
   26    24 S   HC   HB22    34     1.09546   111.31394   176.35299
   27    22 S   N    _N3_    24     1.38127   114.29985    27.07184
   28    27 S   H    _HN3    25     1.01580   119.48121    -2.94377
   29    24 S   S    _SG2    35     1.82353   114.15768   -60.84983
   30    27 S   CT   _CA3    26     1.45263   123.31777   177.79291
   31    30 S   HC   HA31    27     1.09545   107.44134   -65.96484
   32    30 S   HC   HA32    28     1.09529   108.12253    50.45682
   33    29 S   CT   _C22    36     1.82408    99.68333   -68.02538
   34    33 S   HC   _H26    37     1.09421   108.21070    86.95546
   35    33 S   HC   _H27    38     1.09566   110.36456   -29.40016
   36    30 S   CO3  _C3_    29     1.52941   113.99759   172.62975
   37    36 S   O2Z  _O31    30     1.26389   116.03659    -0.23903
   38    36 S   O2Z  _O32    31     1.26418   114.44309   179.62310
   39    33 S   CM   _C21    39     1.51935   109.69939  -149.78659
   40    39 S   CMA  _C20    40     1.36470   123.14188  -102.05791
   41    40 S   OM   _O40    41     1.26884   125.95034    -0.98774
   42    39 S   CT   _C23   106     1.51685   113.35497    79.23120
   43    42 S   HC   _H28   107     1.09468   110.50705   -68.83883
   44    42 S   HC   _H29   108     1.09549   110.04826    50.83167
   45    42 S   HC   _H30   109     1.09314   113.85080   170.21514
   46    40 S   OS   _O39    42     1.41553   111.90864  -179.80517
   47    46 S   CT   _C19    43     1.43593   112.35635  -120.21602
   48    47 S   HC   _H24    44     1.09541   109.01138   -82.45323
   49    47 S   HC   _H25    45     1.09713   110.56323    38.44766
   50    47 S   CT   _C18    46     1.52272   107.65395   158.42003
   51    50 S   HC   _H22    47     1.09541   111.38942   170.29878
   52    50 S   HC   _H23    48     1.09496   110.54130    50.24902
   53    50 S   OS   _O38    49     1.44294   109.67763   -66.88133
   54    53 S   CO4  _C17    50     1.36298   117.41055   -87.79946
   55    54 S   O    _O37    51     1.22569   125.00759    -1.65316
   56    54 S   N    _N5_    52     1.37670   109.51820   178.47890
   57    56 S   H    _H21    53     1.01451   117.83322    -1.76103
   58    56 S   CT   _C16    54     1.45136   123.20814   177.15793
   59    58 S   HC   _H19    55     1.09384   106.60614  -152.96138
   60    58 S   HC   _H20    56     1.09398   107.54516   -36.71088
   61    58 S   CT   _C15    57     1.53369   111.70163    85.50526
   62    61 S   HC   _H17    58     1.09773   108.59023   -58.22486
   63    61 S   HC   _H18    59     1.09561   107.20672    56.61644
   64    61 S   CT   _C14    60     1.55019   115.56327   178.75337
   65    64 S   CT   _C24    61     1.55287   109.80574    53.42519
   66    65 S   HC   _H31    62     1.09591   111.07948    54.22048
   67    65 S   HC   _H32    63     1.09500   112.21041   -66.60396
   68    65 S   HC   _H33    64     1.09651   111.05687   174.09943
   69    64 S   CT   _C25    65     1.54191   110.57100   -64.01009
   70    69 S   HC   _H34    66     1.09208   112.35132   -48.01744
   71    69 S   HC   _H35    67     1.09603   111.45132    71.31044
   72    69 S   HC   _H36    68     1.09565   111.27774  -169.47641
   73    64 S   CT   _C13    69     1.56862   112.48631   170.65712
   74    73 S   HC   _H15    70     1.10098   106.97988   -72.33521
   75    73 S   HC   _H16    71     1.10107   106.11042   176.62240
   76    73 S   CT   _C12    72     1.56710   124.55467    52.28967
   77    76 S   CT   _C26    73     1.54112   111.41771   -75.39363
   78    77 S   HC   _H37    74     1.09151   112.40036    75.75060
   79    77 S   HC   _H38    75     1.09565   111.30624   -45.54936
   80    77 S   HC   _H39    76     1.09605   111.25425  -164.75141
   81    76 S   CT   _C27    77     1.55412   105.83571   169.12779
   82    81 S   HC   _H40    78     1.09598   111.09907   -65.44491
   83    81 S   HC   _H41    79     1.09638   111.02900    54.47676
   84    81 S   HC   _H42    80     1.09570   112.06147   174.03708
   85    76 S   CT   _C11    81     1.54645   112.42221    49.56211
   86    85 S   HC   _H13    82     1.09539   110.14867    47.25952
   87    85 S   HC   _H14    83     1.09384   110.58724   -72.61527
   88    85 S   N    _N4_    84     1.45419   114.04190   165.77313
   89    88 S   H    _H12    85     1.01455   118.30019   -82.72300
   90    88 S   CO4  _C10    86     1.37484   124.41108    96.35322
   91    90 S   O    _O36    87     1.22491   125.68651     1.48108
   92    90 S   OS   _O35    88     1.36228   109.06875  -177.95665
   93    92 S   CT   _C9_    89     1.44096   117.88241   174.83187
   94    93 S   HC   _H10    90     1.09388   111.44875   -16.79317
   95    93 S   HC   _H11    91     1.09411   107.83895   103.11831
   96    93 S   CT   _C8_    92     1.52145   107.96835  -137.73482
   97    96 S   HC   _H8_    93     1.09565   110.39281   -53.54804
   98    96 S   HC   _H9_    94     1.09516   110.03803  -175.33809
   99    96 S   OS   _O34    95     1.43899   108.08997    64.89113
  100    99 S   CO4  _C7_    96     1.35843   115.86180   175.85220
  101   100 S   O    _O33    97     1.22194   126.20089    -2.03894
  102   100 S   CM   _C5_    98     1.48687   109.18349   177.67805
  103   102 S   CM   _C6_    99     1.34077   117.20618   156.82810
  104   103 S   HC   _H6_   100     1.08567   121.01097   179.43559
  105   103 S   HC   _H7_   101     1.08583   122.30499    -1.17437
  106   102 S   CT   _C4_   102     1.49743   119.76645   -24.49385
  107   106 S   HC   _H3_   103     1.09503   110.42823   -54.13723
  108   106 S   HC   _H4_   104     1.09410   110.95750    66.22677
  109   106 S   HC   _H5_   105     1.09531   111.79290  -173.78233
  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   6   5   4   3
  10   4   3   2   1   1   8  10   3   4   2   1   1   7   7   5
   4   6   3   2   5   7   3   8   4   9   5   4  15   5   4  15
  11   4   3   2   7   3   2   1  15   5   4  14  11   4   3   2
   7   3   2   1   7   4   3   5   3   6   2   7   7   5   4   6
   3   2   5   9   3   7   6   2   1   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40    42  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    46    42    43    44    45  
   35    39    40    42  
   39    40    42  
   37    38  
   38  
    0  
   40    41    46    47    42    43    44    45  
   41    46    47    48    49    50    42    43    44    45  
   46    47    42  
   43    44    45    46  
   44    45  
   45  
    0  
   47    48    49    50    51    52    53  
   48    49    50    51    52    53    54  
   49    50    51    52    53  
   50    51    52    53  
   51    52    53    54    55    56  
   52    53    54  
   53    54  
   54    55    56    57    58  
   55    56    57    58    59    60    61  
   56    57    58  
   57    58    59    60    61    62    63    64  
   58    59    60    61  
   59    60    61    62    63    64    65    69    73  
   60    61    62    63    64  
   61    62    63    64  
   62    63    64    65    66    67    68    69    70    71    72    73    74    75    76  
   63    64    65    69    73  
   64    65    69    73  
   65    66    67    68    69    70    71    72    73    74    75    76    77    81    85  
   66    67    68    69    70    71    72    73    74    75    76  
   67    68    69    73  
   68    69    73  
   69    73  
   70    71    72    73    74    75    76  
   71    72    73  
   72    73  
   73  
   74    75    76    77    78    79    80    81    82    83    84    85    86    87    88  
   75    76    77    81    85  
   76    77    81    85  
   77    78    79    80    81    82    83    84    85    86    87    88    89    90  
   78    79    80    81    82    83    84    85    86    87    88  
   79    80    81    85  
   80    81    85  
   81    85  
   82    83    84    85    86    87    88  
   83    84    85  
   84    85  
   85  
   86    87    88    89    90    91    92  
   87    88    89    90  
   88    89    90  
   89    90    91    92    93  
   90    91    92  
   91    92    93    94    95    96  
   92    93  
   93    94    95    96    97    98    99  
   94    95    96    97    98    99   100  
   95    96    97    98    99  
   96    97    98    99  
   97    98    99   100   101   102  
   98    99   100  
   99   100  
  100   101   102   103   106  
  101   102   103   104   105   106   107   108   109  
  102   103   106  
  103   104   105   106   107   108   109  
  104   105   106   107   108   109  
  105   106  
  106  
  107   108   109  
  108   109  
  109  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5500   0.0760  -0.601200   2.0020   1.7750   0.023028004  -0.852763146
   40   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   41   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.8500   0.1400  -0.685000   1.7660   1.5600   0.020110767  -0.896042159
   47   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   52   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   53   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   54   3.7500   0.1050   0.699500   1.9250   1.7000   0.001000000  -0.126889456
   55   2.9600   0.2100  -0.497000   1.5250   1.4250   0.001000000  -1.480495490
   56   3.2500   0.1700  -0.565700   1.8100   1.6000   0.054801302  -1.445846770
   57   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   58   3.5000   0.0660   0.032000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.3810   1.2100   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   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   65   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   77   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   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   0.032000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   88   3.2500   0.1700  -0.565700   1.8100   1.6000   0.054801302  -1.445846770
   89   0.5000   0.0300   0.291200   1.5900   1.4000   0.030040813  -0.651083722
   90   3.7500   0.1050   0.699500   1.9250   1.7000   0.001000000  -0.126889456
   91   2.9600   0.2100  -0.497000   1.5250   1.4250   0.001000000  -1.480495490
   92   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   93   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   95   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   96   3.5000   0.0660   0.190000   1.9750   1.7500   0.005000000  -0.741685710
   97   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   98   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   99   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
  100   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
  101   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
  102   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
  103   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
  104   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  105   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    35   340.000  1.090
   33    39   317.000  1.510
   39    40   465.000  1.376
   39    42   317.000  1.510
   40    41   745.000  1.250
   40    46   440.000  1.360
   46    47   320.000  1.410
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   320.000  1.410
   53    54   214.000  1.327
   54    55   570.000  1.229
   54    56   435.000  1.380
   56    57   434.000  1.010
   56    58   337.000  1.449
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   268.000  1.529
   64    65   268.000  1.529
   64    69   268.000  1.529
   64    73   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    68   340.000  1.090
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    72   340.000  1.090
   73    74   340.000  1.090
   73    75   340.000  1.090
   73    76   268.000  1.529
   76    77   268.000  1.529
   76    81   268.000  1.529
   76    85   268.000  1.529
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    80   340.000  1.090
   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   337.000  1.449
   88    89   434.000  1.010
   88    90   435.000  1.380
   90    91   570.000  1.229
   90    92   214.000  1.327
   92    93   320.000  1.410
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   268.000  1.529
   96    97   340.000  1.090
   96    98   340.000  1.090
   96    99   320.000  1.410
   99   100   214.000  1.327
  100   101   570.000  1.229
  100   102   320.000  1.462
  102   103   549.000  1.340
  102   106   317.000  1.510
  103   104   340.000  1.080
  103   105   340.000  1.080
  106   107   340.000  1.090
  106   108   340.000  1.090
  106   109   340.000  1.090
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   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    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  112.20000
   33    39    40    70.00000  124.00000
   33    39    42    65.00000  117.92700
   35    33    34    33.00000  107.80000
   39    33    34    35.00000  109.50000
   39    33    35    35.00000  109.50000
   39    40    41    65.00000  137.10300
   39    40    46    80.00000  120.01400
   39    42    43    35.00000  109.50000
   39    42    44    35.00000  109.50000
   39    42    45    35.00000  109.50000
   40    46    47    90.00000  111.18400
   46    40    41    65.00000  121.00000
   46    47    48    35.00000  109.50000
   46    47    49    35.00000  109.50000
   46    47    50    50.00000  109.50000
   47    50    51    37.50000  110.70000
   47    50    52    37.50000  110.70000
   47    50    53    50.00000  109.50000
   49    47    48    33.00000  107.80000
   50    47    48    37.50000  110.70000
   50    47    49    37.50000  110.70000
   50    53    54    83.00000  116.90000
   52    50    51    33.00000  107.80000
   53    50    51    35.00000  109.50000
   53    50    52    35.00000  109.50000
   53    54    55    83.00000  123.40000
   53    54    56   110.00000  108.75700
   54    56    57    50.00000  116.34900
   54    56    58    70.00000  120.44000
   56    54    55    85.00000  125.96000
   56    58    59    35.00000  109.50000
   56    58    60    35.00000  109.50000
   56    58    61    70.00000  110.72300
   58    56    57    38.00000  118.40000
   58    61    62    37.50000  110.70000
   58    61    63    37.50000  110.70000
   58    61    64    58.35000  112.70000
   60    58    59    33.00000  107.80000
   61    58    59    37.50000  110.70000
   61    58    60    37.50000  110.70000
   61    64    65    58.35000  112.70000
   61    64    69    58.35000  112.70000
   61    64    73    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    37.50000  110.70000
   64    61    63    37.50000  110.70000
   64    65    66    37.50000  110.70000
   64    65    67    37.50000  110.70000
   64    65    68    37.50000  110.70000
   64    69    70    37.50000  110.70000
   64    69    71    37.50000  110.70000
   64    69    72    37.50000  110.70000
   64    73    74    37.50000  110.70000
   64    73    75    37.50000  110.70000
   64    73    76    58.35000  112.70000
   67    65    66    33.00000  107.80000
   68    65    66    33.00000  107.80000
   68    65    67    33.00000  107.80000
   69    64    65    58.35000  112.70000
   71    69    70    33.00000  107.80000
   72    69    70    33.00000  107.80000
   72    69    71    33.00000  107.80000
   73    64    65    58.35000  112.70000
   73    64    69    58.35000  112.70000
   73    76    77    58.35000  112.70000
   73    76    81    58.35000  112.70000
   73    76    85    58.35000  112.70000
   75    73    74    33.00000  107.80000
   76    73    74    37.50000  110.70000
   76    73    75    37.50000  110.70000
   76    77    78    37.50000  110.70000
   76    77    79    37.50000  110.70000
   76    77    80    37.50000  110.70000
   76    81    82    37.50000  110.70000
   76    81    83    37.50000  110.70000
   76    81    84    37.50000  110.70000
   76    85    86    37.50000  110.70000
   76    85    87    37.50000  110.70000
   76    85    88    70.00000  110.72300
   79    77    78    33.00000  107.80000
   80    77    78    33.00000  107.80000
   80    77    79    33.00000  107.80000
   81    76    77    58.35000  112.70000
   83    81    82    33.00000  107.80000
   84    81    82    33.00000  107.80000
   84    81    83    33.00000  107.80000
   85    76    77    58.35000  112.70000
   85    76    81    58.35000  112.70000
   85    88    89    38.00000  118.40000
   85    88    90    70.00000  120.44000
   87    85    86    33.00000  107.80000
   88    85    86    35.00000  109.50000
   88    85    87    35.00000  109.50000
   88    90    91    85.00000  125.96000
   88    90    92   110.00000  108.75700
   90    88    89    50.00000  116.34900
   90    92    93    83.00000  116.90000
   92    90    91    83.00000  123.40000
   92    93    94    35.00000  109.50000
   92    93    95    35.00000  109.50000
   92    93    96    50.00000  109.50000
   93    96    97    37.50000  110.70000
   93    96    98    37.50000  110.70000
   93    96    99    50.00000  109.50000
   95    93    94    33.00000  107.80000
   96    93    94    37.50000  110.70000
   96    93    95    37.50000  110.70000
   96    99   100    83.00000  116.90000
   98    96    97    33.00000  107.80000
   99    96    97    35.00000  109.50000
   99    96    98    35.00000  109.50000
   99   100   101    83.00000  123.40000
   99   100   102    90.00000  111.29400
  100   102   103    65.00000  118.96000
  100   102   106    65.00000  116.34900
  102   100   101    80.00000  123.72100
  102   103   104    35.00000  120.00000
  102   103   105    35.00000  120.00000
  102   106   107    35.00000  109.50000
  102   106   108    35.00000  109.50000
  102   106   109    35.00000  109.50000
  105   103   104    35.00000  117.00000
  106   102   103    70.00000  124.00000
  108   106   107    33.00000  107.80000
  109   106   107    33.00000  107.80000
  109   106   108    33.00000  107.80000
   42    39    40    70.00000  124.00000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    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    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -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    36    37   0.00000  1.0 1.0
   27    30    36    38   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    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    35   0.32350  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    39    40   0.42700  1.0 1.0
   29    33    39    40  -0.70350 -1.0 2.0
   29    33    39    40  -0.43150  1.0 3.0
   29    33    39    42   0.30250  1.0 1.0
   29    33    39    42  -0.14950 -1.0 2.0
   29    33    39    42   0.36900  1.0 3.0
   33    39    40    41   7.00000 -1.0 2.0
   33    39    40    46   7.00000 -1.0 2.0
   33    39    42    43   0.34800  1.0 3.0
   33    39    42    44   0.34800  1.0 3.0
   33    39    42    45   0.34800  1.0 3.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    42   0.34800  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    42   0.34800  1.0 3.0
   39    40    46    47  -2.26850  1.0 1.0
   39    40    46    47   3.39050 -1.0 2.0
   40    39    42    43   0.00000  1.0 1.0
   40    39    42    44   0.00000  1.0 1.0
   40    39    42    45   0.00000  1.0 1.0
   40    46    47    48   0.08050  1.0 3.0
   40    46    47    49   0.08050  1.0 3.0
   40    46    47    50  -0.46850  1.0 1.0
   40    46    47    50   0.09300 -1.0 2.0
   40    46    47    50  -0.12850  1.0 3.0
   41    40    46    47   2.00000 -1.0 2.0
   46    47    50    51   0.23400  1.0 3.0
   46    47    50    52   0.23400  1.0 3.0
   46    47    50    53   1.11900  1.0 1.0
   46    47    50    53  -1.16350 -1.0 2.0
   46    47    50    53  -0.34150  1.0 3.0
   47    50    53    54  -0.25900  1.0 1.0
   47    50    53    54  -0.47000 -1.0 2.0
   47    50    53    54   0.11750  1.0 3.0
   48    47    50    51   0.15000  1.0 3.0
   48    47    50    52   0.15000  1.0 3.0
   48    47    50    53   0.23400  1.0 3.0
   49    47    50    51   0.15000  1.0 3.0
   49    47    50    52   0.15000  1.0 3.0
   49    47    50    53   0.23400  1.0 3.0
   50    53    54    55   3.00000 -1.0 2.0
   50    53    54    56  -0.80800  1.0 1.0
   50    53    54    56   2.06850 -1.0 2.0
   51    50    53    54   0.08050  1.0 3.0
   52    50    53    54   0.08050  1.0 3.0
   53    54    56    57   2.56700 -1.0 2.0
   53    54    56    58   2.45000 -1.0 2.0
   54    56    58    59   0.00000  1.0 1.0
   54    56    58    60   0.00000  1.0 1.0
   54    56    58    61  -0.43950  1.0 1.0
   54    56    58    61  -0.08100 -1.0 2.0
   54    56    58    61   0.03350  1.0 3.0
   55    54    56    57   2.45000 -1.0 2.0
   55    54    56    58   3.04450 -1.0 2.0
   56    58    61    62   0.15000  1.0 3.0
   56    58    61    63   0.15000  1.0 3.0
   56    58    61    64   0.43900  1.0 1.0
   56    58    61    64   0.49100 -1.0 2.0
   56    58    61    64   0.28400  1.0 3.0
   57    56    58    59   0.00000  1.0 1.0
   57    56    58    60   0.00000  1.0 1.0
   57    56    58    61   0.00000  1.0 1.0
   58    61    64    65   0.56750  1.0 1.0
   58    61    64    65  -0.07550 -1.0 2.0
   58    61    64    65   0.20000  1.0 3.0
   58    61    64    69   0.56750  1.0 1.0
   58    61    64    69  -0.07550 -1.0 2.0
   58    61    64    69   0.20000  1.0 3.0
   58    61    64    73   0.56750  1.0 1.0
   58    61    64    73  -0.07550 -1.0 2.0
   58    61    64    73   0.20000  1.0 3.0
   59    58    61    62   0.15000  1.0 3.0
   59    58    61    63   0.15000  1.0 3.0
   59    58    61    64   0.15000  1.0 3.0
   60    58    61    62   0.15000  1.0 3.0
   60    58    61    63   0.15000  1.0 3.0
   60    58    61    64   0.15000  1.0 3.0
   61    64    65    66   0.15000  1.0 3.0
   61    64    65    67   0.15000  1.0 3.0
   61    64    65    68   0.15000  1.0 3.0
   61    64    69    70   0.15000  1.0 3.0
   61    64    69    71   0.15000  1.0 3.0
   61    64    69    72   0.15000  1.0 3.0
   61    64    73    74   0.15000  1.0 3.0
   61    64    73    75   0.15000  1.0 3.0
   61    64    73    76   0.56750  1.0 1.0
   61    64    73    76  -0.07550 -1.0 2.0
   61    64    73    76   0.20000  1.0 3.0
   62    61    64    65   0.15000  1.0 3.0
   62    61    64    69   0.15000  1.0 3.0
   62    61    64    73   0.15000  1.0 3.0
   63    61    64    65   0.15000  1.0 3.0
   63    61    64    69   0.15000  1.0 3.0
   63    61    64    73   0.15000  1.0 3.0
   64    73    76    77   0.56750  1.0 1.0
   64    73    76    77  -0.07550 -1.0 2.0
   64    73    76    77   0.20000  1.0 3.0
   64    73    76    81   0.56750  1.0 1.0
   64    73    76    81  -0.07550 -1.0 2.0
   64    73    76    81   0.20000  1.0 3.0
   64    73    76    85   0.56750  1.0 1.0
   64    73    76    85  -0.07550 -1.0 2.0
   64    73    76    85   0.20000  1.0 3.0
   65    64    69    70   0.15000  1.0 3.0
   65    64    69    71   0.15000  1.0 3.0
   65    64    69    72   0.15000  1.0 3.0
   65    64    73    74   0.15000  1.0 3.0
   65    64    73    75   0.15000  1.0 3.0
   65    64    73    76   0.56750  1.0 1.0
   65    64    73    76  -0.07550 -1.0 2.0
   65    64    73    76   0.20000  1.0 3.0
   69    64    65    66   0.15000  1.0 3.0
   69    64    65    67   0.15000  1.0 3.0
   69    64    65    68   0.15000  1.0 3.0
   69    64    73    74   0.15000  1.0 3.0
   69    64    73    75   0.15000  1.0 3.0
   69    64    73    76   0.56750  1.0 1.0
   69    64    73    76  -0.07550 -1.0 2.0
   69    64    73    76   0.20000  1.0 3.0
   73    64    65    66   0.15000  1.0 3.0
   73    64    65    67   0.15000  1.0 3.0
   73    64    65    68   0.15000  1.0 3.0
   73    64    69    70   0.15000  1.0 3.0
   73    64    69    71   0.15000  1.0 3.0
   73    64    69    72   0.15000  1.0 3.0
   73    76    77    78   0.15000  1.0 3.0
   73    76    77    79   0.15000  1.0 3.0
   73    76    77    80   0.15000  1.0 3.0
   73    76    81    82   0.15000  1.0 3.0
   73    76    81    83   0.15000  1.0 3.0
   73    76    81    84   0.15000  1.0 3.0
   73    76    85    86   0.15000  1.0 3.0
   73    76    85    87   0.15000  1.0 3.0
   73    76    85    88   0.43900  1.0 1.0
   73    76    85    88   0.49100 -1.0 2.0
   73    76    85    88   0.28400  1.0 3.0
   74    73    76    77   0.15000  1.0 3.0
   74    73    76    81   0.15000  1.0 3.0
   74    73    76    85   0.15000  1.0 3.0
   75    73    76    77   0.15000  1.0 3.0
   75    73    76    81   0.15000  1.0 3.0
   75    73    76    85   0.15000  1.0 3.0
   76    85    88    89   0.00000  1.0 1.0
   76    85    88    90  -0.43950  1.0 1.0
   76    85    88    90  -0.08100 -1.0 2.0
   76    85    88    90   0.03350  1.0 3.0
   77    76    81    82   0.15000  1.0 3.0
   77    76    81    83   0.15000  1.0 3.0
   77    76    81    84   0.15000  1.0 3.0
   77    76    85    86   0.15000  1.0 3.0
   77    76    85    87   0.15000  1.0 3.0
   77    76    85    88   0.43900  1.0 1.0
   77    76    85    88   0.49100 -1.0 2.0
   77    76    85    88   0.28400  1.0 3.0
   81    76    77    78   0.15000  1.0 3.0
   81    76    77    79   0.15000  1.0 3.0
   81    76    77    80   0.15000  1.0 3.0
   81    76    85    86   0.15000  1.0 3.0
   81    76    85    87   0.15000  1.0 3.0
   81    76    85    88   0.43900  1.0 1.0
   81    76    85    88   0.49100 -1.0 2.0
   81    76    85    88   0.28400  1.0 3.0
   85    76    77    78   0.15000  1.0 3.0
   85    76    77    79   0.15000  1.0 3.0
   85    76    77    80   0.15000  1.0 3.0
   85    76    81    82   0.15000  1.0 3.0
   85    76    81    83   0.15000  1.0 3.0
   85    76    81    84   0.15000  1.0 3.0
   85    88    90    91   3.04450 -1.0 2.0
   85    88    90    92   2.45000 -1.0 2.0
   86    85    88    89   0.00000  1.0 1.0
   86    85    88    90   0.00000  1.0 1.0
   87    85    88    89   0.00000  1.0 1.0
   87    85    88    90   0.00000  1.0 1.0
   88    90    92    93  -0.80800  1.0 1.0
   88    90    92    93   2.06850 -1.0 2.0
   89    88    90    91   2.45000 -1.0 2.0
   89    88    90    92   2.56700 -1.0 2.0
   90    92    93    94   0.08050  1.0 3.0
   90    92    93    95   0.08050  1.0 3.0
   90    92    93    96  -0.25900  1.0 1.0
   90    92    93    96  -0.47000 -1.0 2.0
   90    92    93    96   0.11750  1.0 3.0
   91    90    92    93   3.00000 -1.0 2.0
   92    93    96    97   0.23400  1.0 3.0
   92    93    96    98   0.23400  1.0 3.0
   92    93    96    99   1.11900  1.0 1.0
   92    93    96    99  -1.16350 -1.0 2.0
   92    93    96    99  -0.34150  1.0 3.0
   93    96    99   100  -0.25900  1.0 1.0
   93    96    99   100  -0.47000 -1.0 2.0
   93    96    99   100   0.11750  1.0 3.0
   94    93    96    97   0.15000  1.0 3.0
   94    93    96    98   0.15000  1.0 3.0
   94    93    96    99   0.23400  1.0 3.0
   95    93    96    97   0.15000  1.0 3.0
   95    93    96    98   0.15000  1.0 3.0
   95    93    96    99   0.23400  1.0 3.0
   96    99   100   101   3.00000 -1.0 2.0
   96    99   100   102   2.00000 -1.0 2.0
   97    96    99   100   0.08050  1.0 3.0
   98    96    99   100   0.08050  1.0 3.0
   99   100   102   103  -0.56150  1.0 1.0
   99   100   102   103   2.19150 -1.0 2.0
   99   100   102   106  -0.15000  1.0 1.0
   99   100   102   106   0.89550 -1.0 2.0
   99   100   102   106  -0.06900  1.0 3.0
  100   102   103   104   7.00000 -1.0 2.0
  100   102   103   105   7.00000 -1.0 2.0
  100   102   106   107   0.15000  1.0 3.0
  100   102   106   108   0.15000  1.0 3.0
  100   102   106   109   0.15000  1.0 3.0
  101   100   102   103   1.00000 -1.0 2.0
  101   100   102   106  -0.64400  1.0 1.0
  101   100   102   106   0.26850 -1.0 2.0
  103   102   106   107   0.00000  1.0 1.0
  103   102   106   108   0.00000  1.0 1.0
  103   102   106   109   0.00000  1.0 1.0
  106   102   103   104   7.00000 -1.0 2.0
  106   102   103   105   7.00000 -1.0 2.0
   42    39    40    41   7.00000 -1.0 2.0
   42    39    40    46   7.00000 -1.0 2.0
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
   37    30    36    38  10.50000 -1.0 2.0
   33    42    39    40  15.00000 -1.0 2.0
   41    46    40    39  15.00000 -1.0 2.0
   53    56    54    55  10.50000 -1.0 2.0
   57    54    56    58   1.00000 -1.0 2.0
   89    90    88    85   1.00000 -1.0 2.0
   88    92    90    91  10.50000 -1.0 2.0
   99   102   100   101  10.50000 -1.0 2.0
  100   106   102   103  15.00000 -1.0 2.0
  104   105   103   102  15.00000 -1.0 2.0
END
