* LIGAND DATABASE FILE (OPLS2005)
*
001      74    76    131    205     378
    1     0 S   NP   _N1_     1    30.65432   102.23553   -21.82251
    2     1 S   H    _HN1     2     1.02918    33.17178    23.70425
    3     1 S   H    _H1_     3     1.02840    78.60266   173.70783
    4     1 S   H    _H2_     4     1.02840   102.48912   -80.47919
    5     1 S   CT   _CA1     5     1.50106   138.52439    65.08491
    6     5 S   HC   _HA1     6     1.09639   105.00811   156.58438
    7     5 S   CO3  _C1_     7     1.53782   111.89024    37.43161
    8     7 S   O2Z  _O11     8     1.26258   115.31909   -66.26908
    9     7 S   O2Z  _O12     9     1.26324   114.73475   112.10487
   10     5 S   CT   _CB1    10     1.53111   107.24202   -86.61059
   11    10 S   HC   HB11    11     1.09849   108.85931   -53.46134
   12    10 S   HC   HB12    12     1.09776   110.95257    63.02556
   13    10 S   CT   _CG1    13     1.52976   112.36303  -174.41366
   14    13 S   HC   HG11    14     1.09405   110.78444   -76.26327
   15    13 S   HC   HG12    15     1.09651   109.42770    42.79062
   16    13 S   C    _CD1    16     1.51819   111.62186   163.20748
   17    16 S   O    _OE1    17     1.22733   123.08826    24.56736
   18    16 S   N    _N2_    18     1.38531   111.85659  -154.48480
   19    18 S   H    _HN2    19     1.01520   118.79830    -3.49261
   20    18 S   CT1  _CA2    20     1.46189   123.71612   168.32984
   21    20 S   HC   _HA2    21     1.09717   109.53020     9.80470
   22    20 S   C    _C2_    22     1.53960   108.03601  -105.38273
   23    22 S   O    _O2_    23     1.23053   122.30994  -149.37271
   24    20 S   CT   _CB2    32     1.53179   111.36646   132.79606
   25    24 S   HC   HB21    33     1.09493   109.97637    51.85346
   26    24 S   HC   HB22    34     1.09508   110.65132   169.93372
   27    22 S   N    _N3_    24     1.38309   113.81270    37.84756
   28    27 S   H    _HN3    25     1.01470   119.53734    -2.12339
   29    24 S   S    _SG2    35     1.82819   111.53012   -71.96206
   30    27 S   CT   _CA3    26     1.45248   123.82109   178.39319
   31    30 S   HC   HA31    27     1.09530   107.42611   -68.99417
   32    30 S   HC   HA32    28     1.09540   108.21371    47.64864
   33    29 S   CT   _C20    36     1.82283   100.54061   129.16990
   34    33 S   F    F1__    37     1.36228   110.43425    35.85553
   35    33 S   F    F2__    38     1.36519   107.98062   150.21763
   36    30 S   CO3  _C3_    29     1.53116   113.67346   169.67513
   37    36 S   O2Z  _O31    30     1.26449   116.05830    -1.31284
   38    36 S   O2Z  _O32    31     1.26410   114.44712   178.73855
   39    33 S   C5BB _C13    39     1.48863   111.44335   -88.84152
   40    39 S   C5BD _C12    40     1.40495   127.21867   -94.29099
   41    40 S   HA   _H10    41     1.08181   127.52188     1.07046
   42    40 S   C5A  _C11    42     1.38181   106.07228   177.35440
   43    42 S   CA   _C8_    43     1.46104   126.16970  -172.30951
   44    42 S   NA   _N5_    57     1.39783   105.70923     3.59379
   45    43 S   CA   _C7_    44     1.40022   120.26081   -67.29611
   46    45 S   HA   _H7_    45     1.08758   120.65386    -1.23003
   47    44 S   CA   _C14    58     1.42946   130.63468   175.39249
   48    39 S   N5A  _N4_    74     1.33442   121.38943    84.36158
   49    45 S   CA   _C6_    46     1.39720   120.32829   179.09388
   50    49 S   HA   _H6_    47     1.08730   119.16709   179.95577
   51    47 S   CA   _C15    59     1.39912   122.29036   -14.74672
   52    51 S   HA   _H11    60     1.08256   122.84811    -4.11342
   53    49 S   CA   _C5_    48     1.39972   120.52509    -0.00000
   54    51 S   CA   _C16    61     1.39804   120.54594   177.62545
   55    54 S   HA   _H12    62     1.08657   118.98430  -178.98297
   56    53 S   CA   _C10    49     1.39925   119.07402    -1.50792
   57    56 S   HA   _H9_    50     1.08755   120.45405  -178.58307
   58    53 S   CT   _C4_    53     1.49896   120.45838  -178.62712
   59    58 S   HC   _H3_    54     1.09431   110.00982    88.61115
   60    58 S   HC   _H4_    55     1.09511   110.90515  -150.89041
   61    58 S   HC   _H5_    56     1.09509   110.90871   -31.88320
   62    54 S   CA   _C17    63     1.39226   119.72013     0.30132
   63    43 S   CA   _C9_    51     1.40039   120.54279   110.16541
   64    63 S   HA   _H8_    52     1.08689   120.72942     0.80794
   65    62 S   CA   _C18    64     1.39106   120.71038     2.17655
   66    65 S   HA   _H13    65     1.08609   121.53401   179.02904
   67    62 S   SY   _S1_    68     1.76594   119.47749  -178.95115
   68    67 S   OY   _O33    69     1.44930   107.99077  -158.46212
   69    67 S   OY   _O34    70     1.44917   107.72226   -26.52954
   70    47 S   CA   _C19    66     1.40691   118.95578   165.77092
   71    70 S   HA   _H14    67     1.08704   121.77778     0.97438
   72    67 S   NS   _N6_    71     1.70858   100.91439    87.72399
   73    72 S   H    _H15    72     1.03349   115.78141   -17.38570
   74    72 S   H    _H16    73     1.02721   114.61471   112.64706
  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
   8   4   3   2   1   1   7   8   4  12  12  10   8   4  10   2
   9   3   8   4   8   9   3   7   3   4   2   1   1  10   1   1
   7   3   6   4   3   1   1   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    48  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    44    48  
   35    39    40    48  
   39    40    48  
   37    38  
   38  
    0  
   40    41    42    43    44    47    48  
   41    42    43    45    63    44    47    48  
   42    43    44    48  
   43    45    46    49    56    63    64    44    47    51    70    48  
   45    46    49    50    53    56    57    63    64    44    47    48  
   47    51    52    54    65    70    71    48    45    63  
   46    49    50    53    56    63    64    58  
   49    50    53    63  
   51    52    54    55    62    65    66    70    71    48  
   51    70  
   50    53    56    57    63    58    59    60    61  
   53    56    58  
   52    54    55    62    65    70    71    67  
   54    55    62    70  
   56    57    63    64    58    59    60    61  
   55    62    65    66    70    67    68    69    72  
   62    65    67  
   57    63    64    58    59    60    61  
   63    64    58  
   59    60    61    63  
   60    61  
   61  
    0  
   65    66    70    71    67    68    69    72    73    74  
   64  
    0  
   66    70    71    67    68    69    72  
   70    71    67  
   68    69    72    73    74    70  
   69    72    73    74  
   72    73    74  
   71  
    0  
   73    74  
   74  
    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  -0.175000   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   3.2500   0.0620   0.362500   2.4950   1.7500   0.005000000  -0.741685710
   34   2.9500   0.0530  -0.120000   2.4980   2.2250   0.001000000   0.985400000
   35   2.9500   0.0530  -0.120000   2.4980   2.2250   0.001000000   0.985400000
   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   0.0700   0.223000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.5500   0.0700  -0.320000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.150000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5500   0.0700   0.108100   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5500   0.0700   0.062900   2.5000   1.7750   0.001000000  -0.843144165
   44   3.2500   0.1700   0.118900   1.8650   1.6500   0.001000000  -0.511443539
   45   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   46   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   47   3.5500   0.0700   0.073100   2.0020   1.7750   0.001000000  -0.843144165
   48   3.2500   0.1700  -0.531000   1.8650   1.6500   0.001000000  -0.511443539
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5500   0.0700   0.156700   2.5000   1.7750   0.001000000  -0.843144165
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5500   0.2500   0.832700   2.0020   1.7750   0.025682759  -1.666211680
   68   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   69   2.9600   0.1700  -0.468000   1.6780   1.4800   0.001000000  -0.126889456
   70   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   71   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   72   3.2500   0.1700  -0.767800   1.8100   1.6000   0.054801302  -1.445846770
   73   0.5000   0.0300   0.357200   0.9960   0.8600   0.030040813  -0.651083722
   74   0.5000   0.0300   0.357200   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    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   367.000  1.332
   33    35   367.000  1.332
   33    39   295.000  1.498
   39    40   469.000  1.421
   39    48   410.000  1.320
   40    41   367.000  1.080
   40    42   546.000  1.367
   42    43   365.000  1.450
   42    44   427.000  1.381
   43    45   469.000  1.400
   43    63   469.000  1.400
   45    46   367.000  1.080
   45    49   469.000  1.400
   49    50   367.000  1.080
   49    53   469.000  1.400
   53    56   469.000  1.400
   53    58   317.000  1.510
   56    57   367.000  1.080
   56    63   469.000  1.400
   63    64   367.000  1.080
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   44    47   370.000  1.401
   44    48   400.000  1.349
   47    51   469.000  1.400
   47    70   469.000  1.400
   51    52   367.000  1.080
   51    54   469.000  1.400
   54    55   367.000  1.080
   54    62   469.000  1.400
   62    65   469.000  1.400
   62    67   225.000  1.779
   65    66   367.000  1.080
   65    70   469.000  1.400
   70    71   367.000  1.080
   67    68   735.000  1.471
   67    69   735.000  1.471
   67    72   245.000  1.722
   72    73   500.000  1.020
   72    74   500.000  1.020
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    90.00000  110.13500
   29    33    35    90.00000  110.13500
   29    33    39    80.00000  109.48900
   33    39    40    55.00000  128.96000
   33    39    48    70.00000  120.00000
   35    33    34    77.00000  109.10000
   39    33    34    50.00000  109.50000
   39    33    35    50.00000  109.50000
   39    40    41    35.00000  128.20000
   39    40    42    70.00000  103.80000
   39    48    44    70.00000  104.10000
   40    42    43    55.00000  129.60000
   40    42    44    70.00000  109.00000
   42    40    41    35.00000  126.90000
   42    43    45    65.00000  121.65900
   42    43    63    65.00000  121.65900
   42    44    47    65.00000  127.04000
   42    44    48    56.00000  113.10000
   43    45    46    35.00000  120.00000
   43    45    49    63.00000  120.00000
   43    63    56    63.00000  120.00000
   43    63    64    35.00000  120.00000
   45    49    50    35.00000  120.00000
   45    49    53    63.00000  120.00000
   49    45    46    35.00000  120.00000
   49    53    56    63.00000  120.00000
   49    53    58    70.00000  120.00000
   53    49    50    35.00000  120.00000
   53    56    57    35.00000  120.00000
   53    56    63    63.00000  120.00000
   53    58    59    35.00000  109.50000
   53    58    60    35.00000  109.50000
   53    58    61    35.00000  109.50000
   56    63    64    35.00000  120.00000
   63    43    45    63.00000  120.00000
   63    56    57    35.00000  120.00000
   58    53    56    70.00000  120.00000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   44    42    43    75.00000  120.22300
   44    47    51    70.00000  119.05500
   44    47    70    70.00000  119.05500
   47    51    52    35.00000  120.00000
   47    51    54    63.00000  120.00000
   47    70    65    63.00000  120.00000
   47    70    71    35.00000  120.00000
   51    54    55    35.00000  120.00000
   51    54    62    63.00000  120.00000
   54    51    52    35.00000  120.00000
   54    62    65    63.00000  120.00000
   54    62    67    65.00000  117.06700
   62    54    55    35.00000  120.00000
   62    65    66    35.00000  120.00000
   62    65    70    63.00000  120.00000
   62    67    68   100.00000  107.67100
   62    67    69   100.00000  107.67100
   62    67    72    95.00000  101.59200
   65    70    71    35.00000  120.00000
   70    47    51    63.00000  120.00000
   70    65    66    35.00000  120.00000
   67    62    65    65.00000  117.06700
   67    72    73    50.00000  110.93800
   67    72    74    50.00000  110.93800
   69    67    68   115.00000  120.17200
   72    67    68   115.00000  107.22500
   72    67    69   115.00000  107.22500
   74    72    73    35.00000  109.80100
   48    39    40    70.00000  111.90000
   48    44    47    80.00000  119.64000
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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    35   0.01700  1.0 1.0
   24    29    33    35  -0.23550 -1.0 2.0
   24    29    33    35   0.21350  1.0 3.0
   24    29    33    39  -0.23050  1.0 1.0
   24    29    33    39   0.06200 -1.0 2.0
   24    29    33    39   0.47200  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  -0.16000  1.0 1.0
   29    33    39    40  -0.03200 -1.0 2.0
   29    33    39    40   0.04500  1.0 3.0
   29    33    39    48   0.04300 -1.0 2.0
   33    39    40    41   3.62500 -1.0 2.0
   33    39    40    42   3.62500 -1.0 2.0
   33    39    48    44   3.62500 -1.0 2.0
   34    33    39    40   0.00000  1.0 1.0
   34    33    39    48   0.21350  1.0 3.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    48   0.21350  1.0 3.0
   39    40    42    43   3.62500 -1.0 2.0
   39    40   -42    44   3.62500 -1.0 2.0
   40    39   -48    44   3.62500 -1.0 2.0
   40    42    43    45  -0.19450  1.0 1.0
   40    42    43    45   0.63300 -1.0 2.0
   40    42    43    45   0.07450  1.0 3.0
   40    42    43    63  -0.19450  1.0 1.0
   40    42    43    63   0.63300 -1.0 2.0
   40    42    43    63   0.07450  1.0 3.0
   40    42    44    47   3.62500 -1.0 2.0
   40    42   -44    48   3.62500 -1.0 2.0
   41    40    42    43   3.62500 -1.0 2.0
   41    40    42    44   3.62500 -1.0 2.0
   42    43    45    46   3.62500 -1.0 2.0
   42    43    45    49   3.62500 -1.0 2.0
   42    43    63    56   3.62500 -1.0 2.0
   42    43    63    64   3.62500 -1.0 2.0
   42    44    47    51   0.57700 -1.0 2.0
   42    44    47    70   0.57700 -1.0 2.0
   42    44   -48    39   3.62500 -1.0 2.0
   43    42    44    47   3.62500 -1.0 2.0
   43    42    44    48   3.62500 -1.0 2.0
   43    45    49    50   3.62500 -1.0 2.0
   43    45    49    53   3.62500 -1.0 2.0
   45    43    63    56   3.62500 -1.0 2.0
   45    43    63    64   3.62500 -1.0 2.0
   45    49   -53    56   3.62500 -1.0 2.0
   45    49    53    58   3.62500 -1.0 2.0
   46    45    49    50   3.62500 -1.0 2.0
   46    45    49    53   3.62500 -1.0 2.0
   49    53    56    57   3.62500 -1.0 2.0
   49    53    56    63   3.62500 -1.0 2.0
   49    53    58    59   0.00000  1.0 1.0
   49    53    58    60   0.00000  1.0 1.0
   49    53    58    61   0.00000  1.0 1.0
   50    49    53    56   3.62500 -1.0 2.0
   50    49    53    58   3.62500 -1.0 2.0
   53    56   -63    43   3.62500 -1.0 2.0
   53    56    63    64   3.62500 -1.0 2.0
   56    53    58    59   0.00000  1.0 1.0
   56    53    58    60   0.00000  1.0 1.0
   56    53    58    61   0.00000  1.0 1.0
   57    56    63    43   3.62500 -1.0 2.0
   57    56    63    64   3.62500 -1.0 2.0
   63    43    45    46   3.62500 -1.0 2.0
   63    43   -45    49   3.62500 -1.0 2.0
   58    53    56    57   3.62500 -1.0 2.0
   58    53    56    63   3.62500 -1.0 2.0
   44    42    43    45  -0.20000  1.0 1.0
   44    42    43    45   0.58050 -1.0 2.0
   44    42    43    63  -0.20000  1.0 1.0
   44    42    43    63   0.58050 -1.0 2.0
   44    47    51    52   3.62500 -1.0 2.0
   44    47    51    54   3.62500 -1.0 2.0
   44    47    70    65   3.62500 -1.0 2.0
   44    47    70    71   3.62500 -1.0 2.0
   47    44    48    39   3.62500 -1.0 2.0
   47    51    54    55   3.62500 -1.0 2.0
   47    51    54    62   3.62500 -1.0 2.0
   51    47    70    65   3.62500 -1.0 2.0
   51    47    70    71   3.62500 -1.0 2.0
   51    54   -62    65   3.62500 -1.0 2.0
   51    54    62    67   3.62500 -1.0 2.0
   52    51    54    55   3.62500 -1.0 2.0
   52    51    54    62   3.62500 -1.0 2.0
   54    62    65    66   3.62500 -1.0 2.0
   54    62    65    70   3.62500 -1.0 2.0
   54    62    67    68   0.19500  1.0 1.0
   54    62    67    68   0.12000 -1.0 2.0
   54    62    67    69   0.19500  1.0 1.0
   54    62    67    69   0.12000 -1.0 2.0
   54    62    67    72  -0.49050  1.0 1.0
   54    62    67    72   0.22250 -1.0 2.0
   54    62    67    72  -0.39350  1.0 3.0
   55    54    62    65   3.62500 -1.0 2.0
   55    54    62    67   3.62500 -1.0 2.0
   62    65   -70    47   3.62500 -1.0 2.0
   62    65    70    71   3.62500 -1.0 2.0
   62    67    72    73   1.01100  1.0 1.0
   62    67    72    73  -0.22250 -1.0 2.0
   62    67    72    73   1.33750  1.0 3.0
   62    67    72    74   1.01100  1.0 1.0
   62    67    72    74  -0.22250 -1.0 2.0
   62    67    72    74   1.33750  1.0 3.0
   65    62    67    68   0.19500  1.0 1.0
   65    62    67    68   0.12000 -1.0 2.0
   65    62    67    69   0.19500  1.0 1.0
   65    62    67    69   0.12000 -1.0 2.0
   65    62    67    72  -0.49050  1.0 1.0
   65    62    67    72   0.22250 -1.0 2.0
   65    62    67    72  -0.39350  1.0 3.0
   66    65    70    47   3.62500 -1.0 2.0
   66    65    70    71   3.62500 -1.0 2.0
   70    47    51    52   3.62500 -1.0 2.0
   70    47   -51    54   3.62500 -1.0 2.0
   67    62    65    66   3.62500 -1.0 2.0
   67    62    65    70   3.62500 -1.0 2.0
   68    67    72    73   1.12100  1.0 1.0
   68    67    72    73   0.54800 -1.0 2.0
   68    67    72    73  -0.29400  1.0 3.0
   68    67    72    74   1.12100  1.0 1.0
   68    67    72    74   0.54800 -1.0 2.0
   68    67    72    74  -0.29400  1.0 3.0
   69    67    72    73   1.12100  1.0 1.0
   69    67    72    73   0.54800 -1.0 2.0
   69    67    72    73  -0.29400  1.0 3.0
   69    67    72    74   1.12100  1.0 1.0
   69    67    72    74   0.54800 -1.0 2.0
   69    67    72    74  -0.29400  1.0 3.0
   48    39    40    41   3.62500 -1.0 2.0
   48    39   -40    42   3.62500 -1.0 2.0
   48    44    47    51   0.90100 -1.0 2.0
   48    44    47    70   0.90100 -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
   40    48    39    33   4.00000 -1.0 2.0
   42    41    40    39   1.10000 -1.0 2.0
   43    44    42    40   4.00000 -1.0 2.0
   45    63    43    42   4.00000 -1.0 2.0
   49    46    45    43   1.10000 -1.0 2.0
   53    50    49    45   1.10000 -1.0 2.0
   56    58    53    49   4.00000 -1.0 2.0
   63    57    56    53   1.10000 -1.0 2.0
   56    64    63    43   1.10000 -1.0 2.0
   47    48    44    42   4.00000 -1.0 2.0
   51    70    47    44   4.00000 -1.0 2.0
   54    52    51    47   1.10000 -1.0 2.0
   62    55    54    51   1.10000 -1.0 2.0
   65    67    62    54   4.00000 -1.0 2.0
   70    66    65    62   1.10000 -1.0 2.0
   65    71    70    47   1.10000 -1.0 2.0
   74    67    72    73   1.00000 -1.0 2.0
END
