* LIGAND DATABASE FILE (OPLS2005)
*
001      72    75    129    215     383
    1     0 S   NP   _N1_     1    29.17663    99.95239   -24.57364
    2     1 S   H    _HN1     2     1.02798   116.97782   -93.45357
    3     1 S   H    _H1_     3     1.02948    53.99672     0.42151
    4     1 S   H    _H2_     4     1.02827    53.36484   173.62631
    5     1 S   CT   _CA1     5     1.50132   130.87374    87.06957
    6     5 S   HC   _HA1     6     1.09577   105.14087   118.14345
    7     5 S   CO3  _C1_     7     1.53758   112.49782    -2.02371
    8     7 S   O2Z  _O11     8     1.26379   114.99842   -41.69644
    9     7 S   O2Z  _O12     9     1.26238   114.94154   137.27509
   10     5 S   CT   _CB1    10     1.53056   107.40196  -123.90622
   11    10 S   HC   HB11    11     1.09845   109.27705   -49.39590
   12    10 S   HC   HB12    12     1.09811   110.49461    67.18691
   13    10 S   CT   _CG1    13     1.53032   112.66611  -170.33297
   14    13 S   HC   HG11    14     1.09565   110.75570   -68.53298
   15    13 S   HC   HG12    15     1.09670   109.66867    50.71735
   16    13 S   C    _CD1    16     1.51820   111.91542   171.18619
   17    16 S   O    _OE1    17     1.22762   123.14852    14.18680
   18    16 S   N    _N2_    18     1.38653   111.88427  -165.74409
   19    18 S   H    _HN2    19     1.01569   118.97620     0.76719
   20    18 S   CT1  _CA2    20     1.46222   123.35042   175.76478
   21    20 S   HC   _HA2    21     1.09740   109.28141     8.19180
   22    20 S   C    _C2_    22     1.53709   108.77104  -107.27937
   23    22 S   O    _O2_    23     1.23080   122.24719  -148.45572
   24    20 S   CT   _CB2    32     1.53342   111.72281   130.23712
   25    24 S   HC   HB21    33     1.09580   110.13842    56.52014
   26    24 S   HC   HB22    34     1.09424   109.85940   175.57375
   27    22 S   N    _N3_    24     1.38314   113.88005    38.99694
   28    27 S   H    _HN3    25     1.01534   119.63230    -3.01811
   29    24 S   S    _SG2    35     1.82688   111.56955   -64.43656
   30    27 S   CT   _CA3    26     1.45283   123.31757   177.32900
   31    30 S   HC   HA31    27     1.09546   107.49537   -65.41080
   32    30 S   HC   HA32    28     1.09555   108.02922    51.06544
   33    29 S   CT   _C22    36     1.85366    99.56743   175.55785
   34    33 S   HC   _H4_    37     1.09858   108.13516   -40.84735
   35    30 S   CO3  _C3_    29     1.52986   114.00804   173.07321
   36    35 S   O2Z  _O31    30     1.26390   116.07438    -0.61866
   37    35 S   O2Z  _O32    31     1.26423   114.42155   179.44222
   38    33 S   CO4  _C23    38     1.51871   106.98097    75.25455
   39    38 S   O    _O36    39     1.23199   120.68485   -95.23518
   40    38 S   CM   _C18    40     1.50536   118.66127    83.05487
   41    40 S   CM   _C19    41     1.35306   120.04541    16.35185
   42    41 S   CM   _C14    42     1.47169   119.33964  -179.94065
   43    41 S   CO4  _C20    68     1.50699   119.74914    -6.33308
   44    43 S   O    _O35    69     1.23136   119.39692  -154.56670
   45    42 S   CO4  _C15    43     1.50334   112.98372    33.90977
   46    45 S   O    _O39    44     1.22284   124.63775   136.33547
   47    42 S   CM   _C12    50     1.35431   127.09286  -143.28132
   48    33 S   CT   _C21    70     1.54712   116.36241  -163.55159
   49    48 S   OM   _O37    71     1.31983   109.76945    58.92077
   50    48 S   HC   _H3_    72     1.10284   106.61781  -172.43633
   51    45 S   CM   _C16    45     1.48291   113.61866   -42.80828
   52    51 S   HC   _H7_    46     1.08291   118.31114  -156.25312
   53    47 S   CO4  _C13    51     1.49450   123.25437   178.37009
   54    53 S   O    _O34    52     1.22414   123.18653   -37.08864
   55    40 S   CM   _C17    47     1.46802   120.58074  -158.61395
   56    53 S   CA   _C8_    53     1.48234   116.23219   145.88750
   57    55 S   OH   _O38    48     1.38185   119.15530   -17.05417
   58    57 S   HO   _H8_    49     0.97340   109.12663    -2.38245
   59    56 S   CA   _C9_    54     1.39466   120.80985    18.48124
   60    59 S   CA   _C4_    55     1.40758   120.35897  -179.53945
   61    60 S   HA   _H5_    56     1.09212   118.80718  -179.90109
   62    59 S   CO4  _C10    64     1.47600   120.96949     1.90125
   63    62 S   O    _O33    65     1.22136   123.03373   177.97532
   64    60 S   CA   _C5_    57     1.41186   123.12539    -0.10468
   65    64 S   OM   _O42    58     1.27640   122.71115   179.93744
   66    47 S   CO4  _C11    66     1.48594   121.36671     3.43410
   67    66 S   O    _O40    67     1.22019   125.05881    37.81578
   68    64 S   CA   _C6_    59     1.41066   114.56169    -0.19979
   69    68 S   HA   _H6_    60     1.09185   118.88476  -179.92867
   70    56 S   CA   _C7_    61     1.39596   120.96171  -161.54764
   71    70 S   OH   _O41    62     1.36983   123.41224     0.13562
   72    71 S   HO   _H9_    63     0.97361   109.05738    -3.41214
  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   9   5   4   3
  11   7   2   1   1  11   4  12  14  15   7   3   8   4  10   2
   1   1   4   2  10   4   2  12   1   1  11   9   4   5   2   5
   3   1   1   4   2   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    48    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    43    48    49    50  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    55    43    44    48    49    50  
   38    39    40    43    48    49    50  
   36    37  
   37  
    0  
   39    40    41    42    51    55    57    43    48    49    50  
   40    41    55    48  
   41    42    45    51    52    55    57    58    47    43    44    48  
   42    45    46    51    55    57    47    53    66    43    44    48    49    50  
   45    46    51    52    55    47    53    54    56    62    66    67    43    44    48  
   44    48    49    50    45    47    55  
   48    49    50  
   46    51    52    55    57    47    53    66  
   51    52    55    47  
   53    54    56    59    70    62    63    66    67    51  
   49    50  
   50  
    0  
   52    55    57    58  
   55    57  
   54    56    59    60    68    70    71    62    66    67  
   56    59    70    66  
   57    58  
   59    60    61    64    68    69    70    71    72    62    63    66  
   58  
    0  
   60    61    64    65    68    70    71    62    63    66    67  
   61    64    65    68    69    70    62    63    66  
   64    65    68    62  
   63    66    67    64    70  
   66    67  
   65    68    69    70    71  
   68    69    70  
   67  
    0  
   69    70    71    72  
   70    71  
   71    72  
   72  
    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   0.107500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   40   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   41   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   42   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   43   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   45   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   47   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   48   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   49   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   50   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5500   0.0760   0.048800   2.0020   1.7750   0.023028004  -0.852763146
   56   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   57   3.0700   0.1700  -0.404000   1.7660   1.5600   0.021068034  -0.322181743
   58   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   59   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   63   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   64   3.5500   0.0700  -0.170000   2.5000   1.7750   0.001000000  -0.843144165
   65   3.1500   0.2500  -0.830000   1.7825   1.5750   0.001000000  -0.126889456
   66   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   67   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   70   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   71   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   72   0.5000   0.0300   0.435000   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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.522
   33    48   268.000  1.529
   38    39   570.000  1.229
   38    40   320.000  1.462
   40    41   549.000  1.340
   40    55   380.000  1.444
   41    42   380.000  1.444
   41    43   320.000  1.462
   42    45   320.000  1.462
   42    47   549.000  1.340
   45    46   570.000  1.229
   45    51   320.000  1.462
   51    52   340.000  1.080
   51    55   549.000  1.340
   55    57   510.000  1.338
   57    58   553.000  0.945
   47    53   320.000  1.462
   47    66   320.000  1.462
   53    54   570.000  1.229
   53    56   310.000  1.470
   56    59   469.000  1.400
   56    70   469.000  1.400
   59    60   469.000  1.400
   59    62   310.000  1.470
   60    61   367.000  1.080
   60    64   469.000  1.400
   64    65   450.000  1.364
   64    68   469.000  1.400
   68    69   367.000  1.080
   68    70   469.000  1.400
   70    71   450.000  1.364
   71    72   553.000  0.945
   62    63   570.000  1.229
   62    66   250.000  1.523
   66    67   570.000  1.229
   43    44   570.000  1.229
   43    48   317.000  1.522
   48    49   570.000  1.307
   48    50   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    38    75.00000  110.18000
   29    33    48    75.00000  111.63000
   33    38    39    80.00000  120.40000
   33    38    40    65.00000  118.62400
   33    48    43    63.00000  111.10000
   33    48    49    50.00000  109.50000
   33    48    50    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    40    41    65.00000  118.96000
   38    40    55    65.00000  118.96000
   40    38    39    80.00000  123.72100
   40    41    42    70.00000  123.01800
   40    41    43    65.00000  118.96000
   40    55    51    70.00000  123.01800
   40    55    57    80.00000  121.38400
   41    42    45    65.00000  118.96000
   41    42    47    70.00000  123.01800
   41    43    44    80.00000  123.72100
   41    43    48    65.00000  118.62400
   42    45    46    80.00000  123.72100
   42    45    51    65.00000  118.65900
   42    47    53    65.00000  118.96000
   42    47    66    65.00000  118.96000
   45    51    52    40.00000  117.72500
   45    51    55    65.00000  118.96000
   51    45    46    80.00000  123.72100
   51    55    57    80.00000  121.38400
   55    40    41    70.00000  123.01800
   55    51    52    35.00000  120.00000
   55    57    58    70.00000  107.45700
   47    42    45    65.00000  118.96000
   47    53    54    80.00000  123.72100
   47    53    56    65.00000  117.02400
   47    66    62    65.00000  116.00000
   47    66    67    80.00000  123.72100
   53    56    59    60.00000  119.52600
   53    56    70    60.00000  119.52600
   56    53    54    75.00000  123.78400
   56    59    60    63.00000  120.00000
   56    59    62    60.00000  119.52600
   56    70    68    63.00000  120.00000
   56    70    71    70.00000  120.00000
   59    60    61    35.00000  120.00000
   59    60    64    63.00000  120.00000
   59    62    63    75.00000  123.78400
   59    62    66    60.00000  117.28700
   60    64    65    70.00000  120.00000
   60    64    68    63.00000  120.00000
   64    60    61    35.00000  120.00000
   64    68    69    35.00000  120.00000
   64    68    70    63.00000  120.00000
   68    64    65    70.00000  120.00000
   68    70    71    70.00000  120.00000
   70    56    59    63.00000  120.00000
   70    68    69    35.00000  120.00000
   70    71    72    35.00000  113.00000
   62    59    60    60.00000  119.52600
   62    66    67    80.00000  119.30300
   66    47    53    65.00000  115.30000
   66    62    63    80.00000  119.30300
   43    41    42    65.00000  118.96000
   43    48    49    90.00000  108.74100
   43    48    50    35.00000  109.50000
   48    33    34    37.50000  110.70000
   48    33    38    63.00000  111.10000
   48    43    44    80.00000  120.40000
   50    48    49    45.00000  125.66300
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    35    36   0.00000  1.0 1.0
   27    30    35    37   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    38   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    48   0.01700  1.0 1.0
   24    29    33    48  -0.23550 -1.0 2.0
   24    29    33    48   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    39   0.30150 -1.0 2.0
   29    33    38    40   0.65300  1.0 1.0
   29    33    38    40  -0.03850 -1.0 2.0
   29    33    38    40   0.33900  1.0 3.0
   29    33    48    43   0.56750  1.0 1.0
   29    33    48    43  -0.07550 -1.0 2.0
   29    33    48    43   0.20000  1.0 3.0
   29    33    48    49   0.56750  1.0 1.0
   29    33    48    49  -0.07550 -1.0 2.0
   29    33    48    49   0.20000  1.0 3.0
   29    33    48    50   0.15000  1.0 3.0
   33    38    40    41  -0.33500  1.0 1.0
   33    38    40    41   1.06600 -1.0 2.0
   33    38    40    41  -0.14000  1.0 3.0
   33    38    40    55  -0.33500  1.0 1.0
   33    38    40    55   1.06600 -1.0 2.0
   33    38    40    55  -0.14000  1.0 3.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    48    43  -0.11250  1.0 3.0
   34    33    48    49   0.23400  1.0 3.0
   34    33    48    50   0.15000  1.0 3.0
   38    33    48    43   0.11950  1.0 1.0
   38    33    48    43   0.20300 -1.0 2.0
   38    33    48    43  -0.70800  1.0 3.0
   38    33    48    49  -0.09450  1.0 1.0
   38    33    48    49  -1.12950 -1.0 2.0
   38    33    48    49   0.54000  1.0 3.0
   38    33    48    50  -0.11250  1.0 3.0
   38    40    41    42   7.00000 -1.0 2.0
   38    40   -41    43   7.00000 -1.0 2.0
   38    40    55    51  -0.18600  1.0 3.0
   38    40    55    57   1.08500 -1.0 2.0
   39    38    40    41   1.00000 -1.0 2.0
   39    38    40    55   1.00000 -1.0 2.0
   40    41    42    45  -0.18600  1.0 3.0
   40    41    42    47   0.28850  1.0 1.0
   40    41    42    47   2.61350 -1.0 2.0
   40    41    42    47   0.78400  1.0 3.0
   40    41    43    44   1.00000 -1.0 2.0
   40    41    43    48  -0.33500  1.0 1.0
   40    41    43    48   1.06600 -1.0 2.0
   40    41    43    48  -0.14000  1.0 3.0
   40    55    57    58  -0.66100  1.0 1.0
   40    55    57    58   1.20850 -1.0 2.0
   40    55    57    58  -0.36000  1.0 3.0
   41    40    55    51   0.28850  1.0 1.0
   41    40    55    51   2.61350 -1.0 2.0
   41    40    55    51   0.78400  1.0 3.0
   41    40    55    57   0.50950  1.0 1.0
   41    40    55    57   0.56650 -1.0 2.0
   41    40    55    57   0.34050  1.0 3.0
   41    42    45    46   1.00000 -1.0 2.0
   41    42   -45    51  -1.18350  1.0 1.0
   41    42   -45    51   1.45950 -1.0 2.0
   41    42    47    53   7.00000 -1.0 2.0
   41    42    47    66   7.00000 -1.0 2.0
   41    43   -48    33   0.65300  1.0 1.0
   41    43   -48    33  -0.03850 -1.0 2.0
   41    43   -48    33   0.33900  1.0 3.0
   41    43    48    49   0.65300  1.0 1.0
   41    43    48    49  -0.03850 -1.0 2.0
   41    43    48    49   0.33900  1.0 3.0
   41    43    48    50   0.00000  1.0 1.0
   42    41    43    44   1.00000 -1.0 2.0
   42    41    43    48  -0.33500  1.0 1.0
   42    41    43    48   1.06600 -1.0 2.0
   42    41    43    48  -0.14000  1.0 3.0
   42    45    51    52   0.93700 -1.0 2.0
   42    45    51    55  -1.18350  1.0 1.0
   42    45    51    55   1.45950 -1.0 2.0
   42    47    53    54   1.00000 -1.0 2.0
   42    47    53    56  -1.65800  1.0 1.0
   42    47    53    56   0.77650 -1.0 2.0
   42    47    66    62   0.50400  1.0 1.0
   42    47    66    62   1.60000 -1.0 2.0
   42    47    66    62  -0.01800  1.0 3.0
   42    47    66    67   1.00000 -1.0 2.0
   45    42    47    53   7.00000 -1.0 2.0
   45    42    47    66   7.00000 -1.0 2.0
   45    51   -55    40   7.00000 -1.0 2.0
   45    51    55    57   7.00000 -1.0 2.0
   46    45    51    52   0.00000  1.0 1.0
   46    45    51    55   1.00000 -1.0 2.0
   51    55    57    58  -0.66100  1.0 1.0
   51    55    57    58   1.20850 -1.0 2.0
   51    55    57    58  -0.36000  1.0 3.0
   52    51    55    40   7.00000 -1.0 2.0
   52    51    55    57   7.00000 -1.0 2.0
   55    40   -41    42   7.00000 -1.0 2.0
   55    40    41    43   7.00000 -1.0 2.0
   47    42    45    46   1.00000 -1.0 2.0
   47    42    45    51  -1.18350  1.0 1.0
   47    42    45    51   1.45950 -1.0 2.0
   47    53    56    59  -0.11500  1.0 1.0
   47    53    56    59   1.10450 -1.0 2.0
   47    53    56    59  -0.48050  1.0 3.0
   47    53    56    70  -0.11500  1.0 1.0
   47    53    56    70   1.10450 -1.0 2.0
   47    53    56    70  -0.48050  1.0 3.0
   53    47    66    62   1.50000 -1.0 2.0
   53    47    66    67   2.50000 -1.0 2.0
   53    56    59    60   3.62500 -1.0 2.0
   53    56   -59    62   3.62500 -1.0 2.0
   53    56    70    68   3.62500 -1.0 2.0
   53    56    70    71   3.62500 -1.0 2.0
   54    53    56    59   1.05000 -1.0 2.0
   54    53    56    70   1.05000 -1.0 2.0
   56    59    60    61   3.62500 -1.0 2.0
   56    59    60    64   3.62500 -1.0 2.0
   56    59    62    63   1.05000 -1.0 2.0
   56    59    62    66   0.56600 -1.0 2.0
   56    70    71    72   0.84100 -1.0 2.0
   59    56    70    68   3.62500 -1.0 2.0
   59    56    70    71   3.62500 -1.0 2.0
   59    60    64    65   3.62500 -1.0 2.0
   59    60   -64    68   3.62500 -1.0 2.0
   59    62   -66    47   0.43900  1.0 1.0
   59    62   -66    47  -0.18150 -1.0 2.0
   59    62   -66    47  -0.03650  1.0 3.0
   59    62    66    67   0.03000  1.0 1.0
   59    62    66    67   0.58800 -1.0 2.0
   59    62    66    67   0.15550  1.0 3.0
   60    59    62    63   1.05000 -1.0 2.0
   60    59    62    66   0.56600 -1.0 2.0
   60    64    68    69   3.62500 -1.0 2.0
   60    64    68    70   3.62500 -1.0 2.0
   61    60    64    65   3.62500 -1.0 2.0
   61    60    64    68   3.62500 -1.0 2.0
   64    68   -70    56   3.62500 -1.0 2.0
   64    68    70    71   3.62500 -1.0 2.0
   65    64    68    69   3.62500 -1.0 2.0
   65    64    68    70   3.62500 -1.0 2.0
   68    70    71    72   0.84100 -1.0 2.0
   69    68    70    56   3.62500 -1.0 2.0
   69    68    70    71   3.62500 -1.0 2.0
   70    56   -59    60   3.62500 -1.0 2.0
   70    56    59    62   3.62500 -1.0 2.0
   62    59    60    61   3.62500 -1.0 2.0
   62    59    60    64   3.62500 -1.0 2.0
   63    62    66    47   0.03000  1.0 1.0
   63    62    66    47   0.58800 -1.0 2.0
   63    62    66    47   0.15550  1.0 3.0
   63    62    66    67   0.06100 -1.0 2.0
   66    47    53    54   2.50000 -1.0 2.0
   66    47   -53    56   1.50000 -1.0 2.0
   43    41    42    45   1.08500 -1.0 2.0
   43    41    42    47  -0.18600  1.0 3.0
   44    43    48    33   0.30150 -1.0 2.0
   44    43    48    49   0.30150 -1.0 2.0
   44    43    48    50   0.00000  1.0 1.0
   48    33    38    39   0.30150 -1.0 2.0
   48    33   -38    40   0.65300  1.0 1.0
   48    33   -38    40  -0.03850 -1.0 2.0
   48    33   -38    40   0.33900  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
   36    30    35    37  10.50000 -1.0 2.0
   33    40    38    39  10.50000 -1.0 2.0
   38    55    40    41   1.10000 -1.0 2.0
   42    43    41    40   1.10000 -1.0 2.0
   41    45    42    47   1.10000 -1.0 2.0
   42    51    45    46  10.50000 -1.0 2.0
   45    52    51    55   1.10000 -1.0 2.0
   40    57    55    51   1.10000 -1.0 2.0
   53    66    47    42   1.10000 -1.0 2.0
   47    56    53    54  10.50000 -1.0 2.0
   59    70    56    53   4.00000 -1.0 2.0
   60    62    59    56   4.00000 -1.0 2.0
   64    61    60    59   1.10000 -1.0 2.0
   68    65    64    60   4.00000 -1.0 2.0
   70    69    68    64   1.10000 -1.0 2.0
   68    71    70    56   4.00000 -1.0 2.0
   59    66    62    63  10.50000 -1.0 2.0
   47    62    66    67  10.50000 -1.0 2.0
   41    48    43    44  10.50000 -1.0 2.0
END
