* LIGAND DATABASE FILE (OPLS2005)
*
001      71    73    133    205     388
    1     0 S   NP   _N1_     1    29.54073    93.62443   -24.97058
    2     1 S   H    _HN1     2     1.02957    92.67551     1.15809
    3     1 S   H    _H1_     3     1.02827    15.48484   159.80332
    4     1 S   H    _H2_     4     1.02781   108.32787  -109.17252
    5     1 S   CT   _CA1     5     1.50130   122.68373   117.52146
    6     5 S   HC   _HA1     6     1.09569   105.22163    70.36302
    7     5 S   CO3  _C1_     7     1.53834   112.45947   -49.85608
    8     7 S   O2Z  _O11     8     1.26370   115.04209   -40.89612
    9     7 S   O2Z  _O12     9     1.26241   114.95741   138.21636
   10     5 S   CT   _CB1    10     1.53044   107.36729  -171.64459
   11    10 S   HC   HB11    11     1.09830   109.48197   -49.54904
   12    10 S   HC   HB12    12     1.09750   110.29475    66.94471
   13    10 S   CT   _CG1    13     1.52967   112.71922  -170.57147
   14    13 S   HC   HG11    14     1.09585   110.55906   -62.71493
   15    13 S   HC   HG12    15     1.09642   109.96061    56.64637
   16    13 S   C    _CD1    16     1.51690   112.17099   177.22484
   17    16 S   O    _OE1    17     1.22723   123.30045     2.20265
   18    16 S   N    _N2_    18     1.38660   111.78197  -178.19550
   19    18 S   H    _HN2    19     1.01583   119.12629     3.80179
   20    18 S   CT1  _CA2    20     1.46037   123.12505  -177.87036
   21    20 S   HC   _HA2    21     1.09527   109.00566     3.05422
   22    20 S   C    _C2_    22     1.53432   109.70506  -112.10997
   23    22 S   O    _O2_    23     1.23081   122.01988  -151.69322
   24    20 S   CT   _CB2    32     1.53451   111.72025   124.88998
   25    24 S   HC   HB21    33     1.09678   109.30399    68.03963
   26    24 S   HC   HB22    34     1.09486   111.03245  -175.19980
   27    22 S   N    _N3_    24     1.38242   113.88177    35.91368
   28    27 S   H    _HN3    25     1.01591   119.61173    -3.82311
   29    24 S   S    _SG2    35     1.82884   114.93982   -50.94289
   30    27 S   CT   _CA3    26     1.45288   123.15453   176.81998
   31    30 S   HC   HA31    27     1.09552   107.55982   -63.01286
   32    30 S   HC   HA32    28     1.09557   107.91891    53.40433
   33    29 S   CT   _C10    36     1.84236   101.26663   -64.57376
   34    33 S   HC   _H4_    37     1.08670   105.17923    52.86805
   35    30 S   CO3  _C3_    29     1.52942   114.10800   175.35953
   36    35 S   O2Z  _O31    30     1.26370   116.05844    -0.73515
   37    35 S   O2Z  _O32    31     1.26426   114.41252   179.31786
   38    33 S   CT   _C9_    38     1.53132   109.53391   169.93876
   39    38 S   HC   _H3_    39     1.09769   110.20839    30.70993
   40    33 S   CT   _C11    58     1.54029   116.71905   -72.00441
   41    38 S   C5BC _C8_    40     1.51285   115.32198   -92.01453
   42    40 S   CO4  _C18    59     1.51115   104.12818  -130.38707
   43    42 S   O    _O34    60     1.22293   125.26000   179.01444
   44    40 S   OH   _O36    62     1.42745   111.51939   -18.33234
   45    44 S   HO   _H19    63     0.97331   108.33256  -176.27579
   46    41 S   C5BC _C5_    41     1.44434   123.71324   114.31922
   47    38 S   OS   _O35    61     1.43393   106.79696   142.65474
   48    46 S   C5A  _C6_    42     1.37478   106.21665   179.62675
   49    48 S   HA   _H8_    43     1.08067   133.46999   179.95154
   50    46 S   CT   _C4_    68     1.48441   127.93398    -0.38967
   51    50 S   HC   _H5_    69     1.09419   110.56611   -60.64092
   52    50 S   HC   _H6_    70     1.09454   110.54388    59.72451
   53    50 S   HC   _H7_    71     1.09503   111.29611   179.55765
   54    48 S   OA   _O33    44     1.34763   110.89019     0.31404
   55    41 S   C5A  _C7_    45     1.39819   131.10444   -65.70812
   56    55 S   CT   _C16    46     1.50163   138.03886     2.32625
   57    56 S   HC   _H14    47     1.09869   107.30671   109.14024
   58    56 S   HC   _H15    48     1.09865   108.67253  -138.24076
   59    56 S   CM   _C15    49     1.50803   117.36057   -14.77466
   60    59 S   CM   _C14    50     1.34668   118.62298    91.49106
   61    60 S   HC   _H13    51     1.09030   117.95825     6.98056
   62    59 S   CT   _C17    64     1.50371   115.14829   -86.02327
   63    62 S   HC   _H16    65     1.09549   109.52362   -66.51151
   64    62 S   HC   _H17    66     1.09142   113.62872   173.76027
   65    62 S   HC   _H18    67     1.09414   110.98251    52.28671
   66    60 S   CT   _C13    52     1.49448   127.82051  -164.42424
   67    66 S   HC   _H11    53     1.09669   108.56800  -129.99995
   68    66 S   HC   _H12    54     1.09292   112.38153   -13.43172
   69    66 S   CT   _C12    55     1.54498   112.03186   109.84555
   70    69 S   HC   _H9_    56     1.09720   108.96249    72.53876
   71    69 S   HC   _H10    57     1.09887   106.87236  -175.17460
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4  10   5   4   3
  16   8   2   1   1  14   6  13  15   8   3   6   1  10   2   8
   3   5   2   1   1   5   6  10   4   3  10  11   5   4   2   1
   1   5   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    69    40    42    47    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    46    55    66    69    70    71    40    42    43    47    44    45  
   38    39    41    69    40    42    47    44  
   36    37  
   37  
    0  
   39    41    46    48    54    55    56    69    40    42    43    47    44    50  
   41    46    55    40    42    47  
   42    43    47    44    45    41    60    66    67    68    69    70    71  
   46    48    49    54    55    56    57    58    59    42    47    50    51    52    53  
   43    47    44    45    66    69    70    71  
   47    44    69  
   45    47    66    69    70    71  
   69  
   48    49    54    55    56    47    50    51    52    53  
   55    69  
   49    54    55    56    50    51    52    53  
   54    55    50  
   51    52    53    54    55  
   52    53  
   53  
    0  
   55    56    57    58    59  
   56    57    58    59    60    62  
   57    58    59    60    61    66    62    63    64    65  
   58    59    60    62  
   59    60    62  
   60    61    66    67    68    69    62    63    64    65  
   61    66    67    68    69    70    71    62    63    64    65  
   66    67    68    69    62  
   63    64    65    66  
   64    65  
   65  
    0  
   67    68    69    70    71  
   68    69    70    71  
   69    70    71  
   70    71  
   71  
    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   2.5000   0.0300   0.060000   1.4250   1.2500   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   3.5000   0.0660   0.335000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   40   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5500   0.0760  -0.143000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   45   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   46   3.5500   0.0760  -0.143000   2.0020   1.7750   0.001000000  -0.843144165
   47   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   55   3.5500   0.0700   0.008000   2.5000   1.7750   0.001000000  -0.843144165
   56   3.5000   0.0660  -0.005000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   60   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   61   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   3.5000   0.0660  -0.120000   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
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   268.000  1.529
   33    40   268.000  1.529
   38    39   340.000  1.090
   38    41   285.000  1.502
   38    47   320.000  1.410
   41    46   469.000  1.424
   41    55   546.000  1.367
   46    48   546.000  1.367
   46    50   285.000  1.502
   48    49   367.000  1.080
   48    54   340.000  1.360
   54    55   340.000  1.360
   55    56   295.000  1.489
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   317.000  1.510
   59    60   549.000  1.340
   59    62   317.000  1.510
   60    61   340.000  1.080
   60    66   317.000  1.510
   66    67   340.000  1.090
   66    68   340.000  1.090
   66    69   268.000  1.529
   69    70   340.000  1.090
   69    71   340.000  1.090
   69    40   268.000  1.529
   40    42   317.000  1.522
   40    44   320.000  1.410
   42    43   570.000  1.229
   42    47   214.000  1.327
   44    45   553.000  0.945
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   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  111.63000
   29    33    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    41    70.00000  112.17500
   33    38    47    50.00000  109.50000
   33    40    69    58.35000  112.70000
   33    40    42    63.00000  111.10000
   33    40    44    50.00000  109.50000
   38    33    34    37.50000  110.70000
   38    41    46    60.00000  130.00000
   38    41    55    60.00000  130.00000
   38    47    42    83.00000  116.90000
   41    38    39    35.00000  109.50000
   41    46    48    70.00000  107.30000
   41    46    50    60.00000  130.00000
   41    55    54    70.00000  110.60000
   41    55    56    50.00000  133.50000
   46    48    49    35.00000  132.10000
   46    48    54    70.00000  110.60000
   46    50    51    35.00000  109.50000
   46    50    52    35.00000  109.50000
   46    50    53    35.00000  109.50000
   48    54    55    70.00000  106.50000
   54    48    49    35.00000  113.40000
   54    55    56    80.00000  116.10000
   55    41    46    70.00000  107.30000
   55    56    57    45.00000  110.47400
   55    56    58    45.00000  110.47400
   55    56    59    70.00000  112.40000
   56    59    60    70.00000  124.00000
   56    59    62    65.00000  117.92700
   58    56    57    33.00000  107.80000
   59    56    57    35.00000  109.50000
   59    56    58    35.00000  109.50000
   59    60    61    35.00000  120.00000
   59    60    66    70.00000  124.00000
   59    62    63    35.00000  109.50000
   59    62    64    35.00000  109.50000
   59    62    65    35.00000  109.50000
   60    66    67    35.00000  109.50000
   60    66    68    35.00000  109.50000
   60    66    69    70.00000  112.02700
   66    60    61    35.00000  117.00000
   66    69    70    37.50000  110.70000
   66    69    71    37.50000  110.70000
   66    69    40    58.35000  112.70000
   68    66    67    33.00000  107.80000
   69    66    67    37.50000  110.70000
   69    66    68    37.50000  110.70000
   69    40    42    63.00000  111.10000
   69    40    44    50.00000  109.50000
   71    69    70    33.00000  107.80000
   40    33    34    37.50000  110.70000
   40    33    38    58.35000  112.70000
   40    69    70    37.50000  110.70000
   40    69    71    37.50000  110.70000
   40    42    43    80.00000  120.40000
   40    42    47    81.00000  111.40000
   40    44    45    55.00000  108.50000
   47    38    39    35.00000  109.50000
   47    38    41    85.00000  111.85700
   47    42    43    83.00000  123.40000
   44    40    42    90.00000  109.61100
   62    59    60    70.00000  124.00000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   50    46    48    60.00000  130.00000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    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    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    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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   0.15000  1.0 3.0
   29    33    38    41   0.56750  1.0 1.0
   29    33    38    41  -0.07550 -1.0 2.0
   29    33    38    41   0.20000  1.0 3.0
   29    33    38    47   0.56750  1.0 1.0
   29    33    38    47  -0.07550 -1.0 2.0
   29    33    38    47   0.20000  1.0 3.0
   29    33    40    69   0.44750  1.0 1.0
   29    33    40    69  -0.17800 -1.0 2.0
   29    33    40    69   0.20200  1.0 3.0
   29    33    40    42   0.56750  1.0 1.0
   29    33    40    42  -0.07550 -1.0 2.0
   29    33    40    42   0.20000  1.0 3.0
   29    33    40    44   0.56750  1.0 1.0
   29    33    40    44  -0.07550 -1.0 2.0
   29    33    40    44   0.20000  1.0 3.0
   33    38    41    46   0.04150 -1.0 2.0
   33    38    41    55   0.04150 -1.0 2.0
   33    38   -47    42  -0.25900  1.0 1.0
   33    38   -47    42  -0.47000 -1.0 2.0
   33    38   -47    42   0.11750  1.0 3.0
   33    40    42    43   0.30150 -1.0 2.0
   33    40   -42    47   0.36750  1.0 3.0
   33    40    44    45  -0.11600  1.0 1.0
   33    40    44    45  -0.09450 -1.0 2.0
   33    40    44    45   0.21250  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    41   0.43200  1.0 3.0
   34    33    38    47   0.23400  1.0 3.0
   34    33    40    69   0.15000  1.0 3.0
   34    33    40    42  -0.11250  1.0 3.0
   34    33    40    44   0.23400  1.0 3.0
   38    33    40    69   0.56750  1.0 1.0
   38    33    40    69  -0.07550 -1.0 2.0
   38    33    40    69   0.20000  1.0 3.0
   38    33   -40    42  -0.95700  1.0 1.0
   38    33   -40    42  -0.18200 -1.0 2.0
   38    33   -40    42   0.29450  1.0 3.0
   38    33    40    44   0.86500  1.0 1.0
   38    33    40    44  -0.17500 -1.0 2.0
   38    33    40    44   0.20800  1.0 3.0
   38    41    46    48   3.62500 -1.0 2.0
   38    41    46    50   3.62500 -1.0 2.0
   38    41    55    54   3.62500 -1.0 2.0
   38    41    55    56   3.62500 -1.0 2.0
   39    38    41    46   0.00000  1.0 1.0
   39    38    41    55   0.00000  1.0 1.0
   39    38    47    42   0.08050  1.0 3.0
   41    38    47    42  -0.43900 -1.0 2.0
   41    38    47    42   0.14100  1.0 3.0
   41    46    48    49   3.62500 -1.0 2.0
   41    46   -48    54   3.62500 -1.0 2.0
   41    46    50    51   0.00000  1.0 1.0
   41    46    50    52   0.00000  1.0 1.0
   41    46    50    53   0.00000  1.0 1.0
   41    55    56    57   0.00000  1.0 1.0
   41    55    56    58   0.00000  1.0 1.0
   41    55    56    59   0.18050 -1.0 2.0
   46    41   -55    54   3.62500 -1.0 2.0
   46    41    55    56   3.62500 -1.0 2.0
   46    48   -54    55   3.62500 -1.0 2.0
   48    46    50    51   0.00000  1.0 1.0
   48    46    50    52   0.00000  1.0 1.0
   48    46    50    53   0.00000  1.0 1.0
   48    54   -55    41   3.62500 -1.0 2.0
   48    54    55    56   3.62500 -1.0 2.0
   49    48    54    55   3.62500 -1.0 2.0
   54    55    56    57   0.00000  1.0 1.0
   54    55    56    58   0.00000  1.0 1.0
   54    55    56    59   0.04300 -1.0 2.0
   55    41   -46    48   3.62500 -1.0 2.0
   55    41    46    50   3.62500 -1.0 2.0
   55    56    59    60   1.44450  1.0 1.0
   55    56    59    60   0.06600 -1.0 2.0
   55    56    59    60   0.29250  1.0 3.0
   55    56    59    62   0.09700  1.0 1.0
   55    56    59    62   0.15600 -1.0 2.0
   55    56    59    62  -0.50800  1.0 3.0
   56    59    60    61   7.00000 -1.0 2.0
   56    59    60    66   7.00000 -1.0 2.0
   56    59    62    63   0.34800  1.0 3.0
   56    59    62    64   0.34800  1.0 3.0
   56    59    62    65   0.34800  1.0 3.0
   57    56    59    60   0.00000  1.0 1.0
   57    56    59    62   0.34800  1.0 3.0
   58    56    59    60   0.00000  1.0 1.0
   58    56    59    62   0.34800  1.0 3.0
   59    60    66    67   0.00000  1.0 1.0
   59    60    66    68   0.00000  1.0 1.0
   59    60    66    69   0.09850  1.0 1.0
   59    60    66    69   0.15250 -1.0 2.0
   59    60    66    69  -0.50650  1.0 3.0
   60    59    62    63   0.00000  1.0 1.0
   60    59    62    64   0.00000  1.0 1.0
   60    59    62    65   0.00000  1.0 1.0
   60    66    69    70   0.15000  1.0 3.0
   60    66    69    71   0.15000  1.0 3.0
   60    66    69    40   0.34400  1.0 1.0
   60    66    69    40   0.09450 -1.0 2.0
   60    66    69    40   0.11100  1.0 3.0
   61    60    66    67   0.33100  1.0 3.0
   61    60    66    68   0.33100  1.0 3.0
   61    60    66    69   0.00000  1.0 1.0
   66    69    40    33   0.56750  1.0 1.0
   66    69    40    33  -0.07550 -1.0 2.0
   66    69    40    33   0.20000  1.0 3.0
   66    69    40    42  -0.95700  1.0 1.0
   66    69    40    42  -0.18200 -1.0 2.0
   66    69    40    42   0.29450  1.0 3.0
   66    69    40    44   0.86500  1.0 1.0
   66    69    40    44  -0.17500 -1.0 2.0
   66    69    40    44   0.20800  1.0 3.0
   67    66    69    70   0.15000  1.0 3.0
   67    66    69    71   0.15000  1.0 3.0
   67    66    69    40   0.15000  1.0 3.0
   68    66    69    70   0.15000  1.0 3.0
   68    66    69    71   0.15000  1.0 3.0
   68    66    69    40   0.15000  1.0 3.0
   69    40    42    43   0.30150 -1.0 2.0
   69    40    42    47   0.36750  1.0 3.0
   69    40    44    45  -0.11600  1.0 1.0
   69    40    44    45  -0.09450 -1.0 2.0
   69    40    44    45   0.21250  1.0 3.0
   70    69    40    33   0.15000  1.0 3.0
   70    69    40    42  -0.11250  1.0 3.0
   70    69    40    44   0.23400  1.0 3.0
   71    69    40    33   0.15000  1.0 3.0
   71    69    40    42  -0.11250  1.0 3.0
   71    69    40    44   0.23400  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33    38    41  -0.03700  1.0 1.0
   40    33    38    41   0.37200 -1.0 2.0
   40    33    38    41  -0.47300  1.0 3.0
   40    33   -38    47   0.62750  1.0 1.0
   40    33   -38    47  -0.30950 -1.0 2.0
   40    33   -38    47   0.27300  1.0 3.0
   40    42   -47    38   1.63150  1.0 1.0
   40    42   -47    38   2.92000 -1.0 2.0
   42    40    44    45   0.91850  1.0 1.0
   42    40    44    45   0.57950  1.0 3.0
   43    42    47    38   3.00000 -1.0 2.0
   47    38    41    46   0.64500  1.0 1.0
   47    38    41    46   0.14800 -1.0 2.0
   47    38    41    46   0.20650  1.0 3.0
   47    38    41    55   0.64500  1.0 1.0
   47    38    41    55   0.14800 -1.0 2.0
   47    38    41    55   0.20650  1.0 3.0
   44    40    42    43   0.30150 -1.0 2.0
   44    40    42    47   0.30750  1.0 1.0
   44    40    42    47   1.13850 -1.0 2.0
   44    40    42    47   0.38850  1.0 3.0
   62    59    60    61   7.00000 -1.0 2.0
   62    59    60    66   7.00000 -1.0 2.0
   50    46    48    49   3.62500 -1.0 2.0
   50    46    48    54   3.62500 -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
   36    30    35    37  10.50000 -1.0 2.0
   46    55    41    38   4.00000 -1.0 2.0
   48    50    46    41   4.00000 -1.0 2.0
   54    49    48    46   1.10000 -1.0 2.0
   54    56    55    41   4.00000 -1.0 2.0
   56    62    59    60   1.10000 -1.0 2.0
   66    61    60    59   1.10000 -1.0 2.0
   40    47    42    43  10.50000 -1.0 2.0
END
