* LIGAND DATABASE FILE (OPLS2005)
*
001      62    63    121    191     351
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02065    85.22169    47.78436
    3     1 S   H    _H1_     3     1.02116    33.77037  -177.55319
    4     1 S   H    _H2_     4     1.02113    94.81685   -60.63861
    5     1 S   CT   _CA1     5     1.47350   143.09843   165.65738
    6     5 S   HC   _HA1     6     1.05972   107.41041    47.01581
    7     5 S   CO3  _C1_     7     1.53908   109.34128   -68.19590
    8     7 S   O2Z  _O11     8     1.25095   118.44911   -27.27841
    9     7 S   O2Z  _O12     9     1.24883   117.20318   152.23358
   10     5 S   CT   _CB1    10     1.54281   111.03918   167.74441
   11    10 S   HC   HB11    11     1.08929   109.26512   -44.52311
   12    10 S   HC   HB12    12     1.08772   109.34450    72.20433
   13    10 S   CT   _CG1    13     1.53934   112.63786  -165.89722
   14    13 S   HC   HG11    14     1.10479   110.04768   -59.32622
   15    13 S   HC   HG12    15     1.10493   110.13804    57.98762
   16    13 S   C    _CD1    16     1.52596   114.68728   179.10606
   17    16 S   O    _OE1    17     1.22981   121.36416   -16.08130
   18    16 S   N    _N2_    18     1.34015   114.76575   162.47883
   19    18 S   H    _HN2    19     1.04748   118.84952     8.59078
   20    18 S   CT1  _CA2    20     1.46338   126.89443  -171.32586
   21    20 S   HC   _HA2    21     1.08457   106.27517   -11.11459
   22    20 S   C    _C2_    22     1.54037   112.60135  -130.27230
   23    22 S   O    _O2_    23     1.23085   119.01196  -169.64989
   24    20 S   CT   _CB2    32     1.54652   109.46586   105.32505
   25    24 S   HC   HB21    33     1.08491   110.62044    58.72541
   26    24 S   HC   HB22    34     1.08584   110.00631   179.17671
   27    22 S   N    _N3_    24     1.34263   118.97450    10.45203
   28    27 S   H    _HN3    25     1.03492   120.05970     5.06895
   29    24 S   S    _SG2    35     1.81647   112.43692   -61.22030
   30    27 S   CT   _CA3    26     1.46098   124.53040  -172.10347
   31    30 S   HC   HA31    27     1.12298   109.15732    14.31073
   32    30 S   HC   HA32    28     1.12301   109.23063   127.81991
   33    29 S   CT   _C10    36     1.85849    96.76260   161.85565
   34    30 S   CO3  _C3_    29     1.53166   113.47286  -108.98504
   35    34 S   O2Z  _O31    30     1.24973   119.17393     1.13142
   36    34 S   O2Z  _O32    31     1.25025   116.29664   179.33914
   37    33 S   C4T  _C7_    37     1.55634   106.39590    39.97704
   38    37 S   HC   _H18    38     1.09732   112.58416   -67.40224
   39    33 S   CT   _C13    59     1.54151   105.82839   -75.12138
   40    39 S   HC   _H26    60     1.08464   109.12158   -66.25830
   41    39 S   HC   _H27    61     1.08448   109.14163   173.81702
   42    39 S   HC   _H28    62     1.08355   109.19944    53.80843
   43    37 S   C4T  _C4_    39     1.56837   115.81441    64.91792
   44    43 S   HC   _H13    40     1.09344   118.11284   -37.49237
   45    43 S   HC   _H14    41     1.09677   115.23039  -165.03667
   46    37 S   C4T  _C9_    50     1.56841   113.71264   159.88614
   47    43 S   C4T  _C6_    42     1.55089    84.86353    79.17270
   48    47 S   HC   _H17    43     1.09512   113.96305   150.74855
   49    46 S   CT   _C11    51     1.52934   112.35590   165.75624
   50    49 S   HC   _H20    52     1.08715   109.71144   -86.50861
   51    49 S   HC   _H21    53     1.08817   109.70872   153.49047
   52    49 S   HC   _H22    54     1.08819   109.72711    33.53192
   53    46 S   CT   _C12    55     1.51077   122.54794    38.70803
   54    53 S   HC   _H23    56     1.09387   110.62509    77.67921
   55    53 S   HC   _H24    57     1.09464   110.65253   -42.35704
   56    53 S   HC   _H25    58     1.09495   110.62663  -162.40094
   57    47 S   CT   _C5_    44     1.53693   111.00656   -81.57838
   58    57 S   HC   _H15    45     1.09866   109.14136  -168.81077
   59    57 S   HC   _H16    46     1.09955   109.09817   -53.26227
   60    33 S   CT   _C8_    47     1.58214   116.84955   161.87175
   61    60 S   OM   _O33    48     1.32319   112.20192    33.32522
   62    60 S   HC   _H19    49     1.10548   105.45856   159.29354
  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  13   5   4   3
  19   2   1   1  23   9   9   3   2   1  11   5   4  14  15   6
   8   3   2   1   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    60    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    57    60    61    62    46    39    40    41    42  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    43    44    45    47    57    58    59    60    61    62    46    49    53    39    40    41    42  
   35    36  
   36  
    0  
   38    43    44    45    47    48    57    60    61    62    46    49    50    51    52    53    54    55    56    39    40    41    42  
   43    44    45    47    60    46    49    53    39  
   40    41    42    43    46    57    60    61    62  
   41    42    60  
   42    60  
   60  
   44    45    47    48    57    58    59    60    46    49    53  
   45    47    48    57    46  
   47    48    57    46  
   49    50    51    52    53    54    55    56    47    48    57    58    59    60  
   48    57    58    59    60    61    62    49    50    51    52    53    54    55    56  
   57    58    59    60    49    53  
   50    51    52    53    54    55    56    57  
   51    52    53  
   52    53  
   53  
   54    55    56    57  
   55    56  
   56  
    0  
   58    59    60    61    62  
   59    60    61    62  
   60    61    62  
   61    62  
   62  
    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   0.226300   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.5000   0.0660  -0.118800   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660  -0.117600   1.9750   1.7500   0.005000000  -0.741685710
   47   3.5000   0.0660  -0.118800   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.121200   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5000   0.0660  -0.061200   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   61   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   62   2.5000   0.0500   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    37   260.000  1.519
   33    60   268.000  1.529
   33    39   268.000  1.529
   37    38   340.000  1.090
   37    43   268.000  1.529
   37    46   268.000  1.529
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    47   268.000  1.529
   47    48   340.000  1.090
   47    57   260.000  1.519
   47    46   268.000  1.529
   57    58   340.000  1.090
   57    59   340.000  1.090
   57    60   268.000  1.529
   60    61   570.000  1.307
   60    62   340.000  1.090
   46    49   260.000  1.519
   46    53   260.000  1.519
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    52   340.000  1.090
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    42   340.000  1.090
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    75.00000  111.63000
   29    33    60    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    45.00000  112.72800
   33    37    43    65.00000  119.52000
   33    37    46    65.00000  119.52000
   33    60    57    58.35000  112.70000
   33    60    61    50.00000  109.50000
   33    60    62    37.50000  110.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    42    37.50000  110.70000
   37    43    44    37.50000  110.70000
   37    43    45    37.50000  110.70000
   37    43    47    63.00000   92.00000
   37    46    47    63.00000   92.00000
   37    46    49    65.00000  119.52000
   37    46    53    65.00000  119.52000
   43    37    38    37.50000  110.70000
   43    47    48    37.50000  110.70000
   43    47    57    65.00000  119.52000
   43    47    46    63.00000   92.00000
   45    43    44    33.00000  107.80000
   47    43    44    37.50000  110.70000
   47    43    45    37.50000  110.70000
   47    57    58    45.00000  111.22300
   47    57    59    45.00000  111.22300
   47    57    60    70.00000  112.98000
   47    46    49    65.00000  119.52000
   47    46    53    65.00000  119.52000
   57    47    48    45.00000  112.72800
   57    60    61    50.00000  109.50000
   57    60    62    37.50000  110.70000
   59    57    58    33.00000  107.80000
   60    33    37    70.00000  112.98000
   60    57    58    37.50000  110.70000
   60    57    59    37.50000  110.70000
   62    60    61    45.00000  125.66300
   46    37    38    37.50000  110.70000
   46    37    43    63.00000   92.00000
   46    47    48    37.50000  110.70000
   46    47    57    65.00000  119.52000
   46    49    50    45.00000  111.22300
   46    49    51    45.00000  111.22300
   46    49    52    45.00000  111.22300
   46    53    54    45.00000  111.22300
   46    53    55    45.00000  111.22300
   46    53    56    45.00000  111.22300
   51    49    50    33.00000  107.80000
   52    49    50    33.00000  107.80000
   52    49    51    33.00000  107.80000
   53    46    49    58.35000  112.70000
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   39    33    37    70.00000  112.98000
   39    33    60    58.35000  112.70000
   41    39    40    33.00000  107.80000
   42    39    40    33.00000  107.80000
   42    39    41    33.00000  107.80000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    60   0.01700  1.0 1.0
   24    29    33    60  -0.23550 -1.0 2.0
   24    29    33    60   0.21350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    37    38   0.15000  1.0 3.0
   29    33    37    43   0.44750  1.0 1.0
   29    33    37    43  -0.17800 -1.0 2.0
   29    33    37    43   0.20200  1.0 3.0
   29    33    37    46   0.44750  1.0 1.0
   29    33    37    46  -0.17800 -1.0 2.0
   29    33    37    46   0.20200  1.0 3.0
   29    33    60    57   0.44750  1.0 1.0
   29    33    60    57  -0.17800 -1.0 2.0
   29    33    60    57   0.20200  1.0 3.0
   29    33    60    61   0.56750  1.0 1.0
   29    33    60    61  -0.07550 -1.0 2.0
   29    33    60    61   0.20000  1.0 3.0
   29    33    60    62   0.15000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    42   0.15000  1.0 3.0
   33    37    43    44   0.15000  1.0 3.0
   33    37    43    45   0.15000  1.0 3.0
   33    37    43    47  -0.70950  1.0 1.0
   33    37    43    47   0.38400 -1.0 2.0
   33    37   -46    47  -0.70950  1.0 1.0
   33    37   -46    47   0.38400 -1.0 2.0
   33    37    46    49   0.56750  1.0 1.0
   33    37    46    49  -0.07550 -1.0 2.0
   33    37    46    49   0.20000  1.0 3.0
   33    37    46    53   0.56750  1.0 1.0
   33    37    46    53  -0.07550 -1.0 2.0
   33    37    46    53   0.20000  1.0 3.0
   37    33    60    57   0.31550 -1.0 2.0
   37    33    60    57   0.11250  1.0 3.0
   37    33    60    61   0.62750  1.0 1.0
   37    33    60    61  -0.30950 -1.0 2.0
   37    33    60    61   0.27300  1.0 3.0
   37    33    60    62   0.15000  1.0 3.0
   37    33    39    40   0.15000  1.0 3.0
   37    33    39    41   0.15000  1.0 3.0
   37    33    39    42   0.15000  1.0 3.0
   37    43    47    48   0.15000  1.0 3.0
   37    43   -47    57  -0.70950  1.0 1.0
   37    43   -47    57   0.38400 -1.0 2.0
   37    43   -47    46   0.00000  1.0 1.0
   37    46    49    50   0.00000  1.0 1.0
   37    46    49    51   0.00000  1.0 1.0
   37    46    49    52   0.00000  1.0 1.0
   37    46    53    54   0.00000  1.0 1.0
   37    46    53    55   0.00000  1.0 1.0
   37    46    53    56   0.00000  1.0 1.0
   38    37    43    44   0.15000  1.0 3.0
   38    37    43    45   0.15000  1.0 3.0
   38    37    43    47   0.15000  1.0 3.0
   38    37   -46    47   0.15000  1.0 3.0
   38    37    46    49   0.15000  1.0 3.0
   38    37    46    53   0.15000  1.0 3.0
   43    37   -46    47   0.00000  1.0 1.0
   43    37    46    49  -0.70950  1.0 1.0
   43    37    46    49   0.38400 -1.0 2.0
   43    37    46    53  -0.70950  1.0 1.0
   43    37    46    53   0.38400 -1.0 2.0
   43    47    57    58   0.00000  1.0 1.0
   43    47    57    59   0.00000  1.0 1.0
   43    47    57    60   0.04050  1.0 1.0
   43    47    57    60   0.63700 -1.0 2.0
   43    47    57    60   0.17650  1.0 3.0
   43    47   -46    37   0.00000  1.0 1.0
   43    47   -46    49  -0.70950  1.0 1.0
   43    47   -46    49   0.38400 -1.0 2.0
   43    47   -46    53  -0.70950  1.0 1.0
   43    47   -46    53   0.38400 -1.0 2.0
   44    43    47    48   0.15000  1.0 3.0
   44    43    47    57   0.15000  1.0 3.0
   44    43    47    46   0.15000  1.0 3.0
   45    43    47    48   0.15000  1.0 3.0
   45    43    47    57   0.15000  1.0 3.0
   45    43    47    46   0.15000  1.0 3.0
   47    57   -60    33   0.31550 -1.0 2.0
   47    57   -60    33   0.11250  1.0 3.0
   47    57    60    61   0.62750  1.0 1.0
   47    57    60    61  -0.30950 -1.0 2.0
   47    57    60    61   0.27300  1.0 3.0
   47    57    60    62   0.15000  1.0 3.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    51   0.00000  1.0 1.0
   47    46    49    52   0.00000  1.0 1.0
   47    46    53    54   0.00000  1.0 1.0
   47    46    53    55   0.00000  1.0 1.0
   47    46    53    56   0.00000  1.0 1.0
   48    47    57    58   0.15000  1.0 3.0
   48    47    57    59   0.15000  1.0 3.0
   48    47    57    60   0.15000  1.0 3.0
   48    47   -46    37   0.15000  1.0 3.0
   48    47    46    49   0.15000  1.0 3.0
   48    47    46    53   0.15000  1.0 3.0
   57    47   -46    37  -0.70950  1.0 1.0
   57    47   -46    37   0.38400 -1.0 2.0
   57    47    46    49   0.56750  1.0 1.0
   57    47    46    49  -0.07550 -1.0 2.0
   57    47    46    49   0.20000  1.0 3.0
   57    47    46    53   0.56750  1.0 1.0
   57    47    46    53  -0.07550 -1.0 2.0
   57    47    46    53   0.20000  1.0 3.0
   58    57    60    33   0.15000  1.0 3.0
   58    57    60    61   0.23400  1.0 3.0
   58    57    60    62   0.15000  1.0 3.0
   59    57    60    33   0.15000  1.0 3.0
   59    57    60    61   0.23400  1.0 3.0
   59    57    60    62   0.15000  1.0 3.0
   60    33    37    38   0.15000  1.0 3.0
   60    33   -37    43   0.04050  1.0 1.0
   60    33   -37    43   0.63700 -1.0 2.0
   60    33   -37    43   0.17650  1.0 3.0
   60    33    37    46   0.04050  1.0 1.0
   60    33    37    46   0.63700 -1.0 2.0
   60    33    37    46   0.17650  1.0 3.0
   60    33    39    40   0.15000  1.0 3.0
   60    33    39    41   0.15000  1.0 3.0
   60    33    39    42   0.15000  1.0 3.0
   46    37   -43    44   0.15000  1.0 3.0
   46    37   -43    45   0.15000  1.0 3.0
   46    37   -43    47   0.00000  1.0 1.0
   46    47    57    58   0.00000  1.0 1.0
   46    47    57    59   0.00000  1.0 1.0
   46    47   -57    60   0.04050  1.0 1.0
   46    47   -57    60   0.63700 -1.0 2.0
   46    47   -57    60   0.17650  1.0 3.0
   49    46    53    54   0.15000  1.0 3.0
   49    46    53    55   0.15000  1.0 3.0
   49    46    53    56   0.15000  1.0 3.0
   53    46    49    50   0.15000  1.0 3.0
   53    46    49    51   0.15000  1.0 3.0
   53    46    49    52   0.15000  1.0 3.0
   39    33    37    38   0.15000  1.0 3.0
   39    33    37    43   0.04050  1.0 1.0
   39    33    37    43   0.63700 -1.0 2.0
   39    33    37    43   0.17650  1.0 3.0
   39    33    37    46   0.04050  1.0 1.0
   39    33    37    46   0.63700 -1.0 2.0
   39    33    37    46   0.17650  1.0 3.0
   39    33    60    57   0.56750  1.0 1.0
   39    33    60    57  -0.07550 -1.0 2.0
   39    33    60    57   0.20000  1.0 3.0
   39    33    60    61   0.62750  1.0 1.0
   39    33    60    61  -0.30950 -1.0 2.0
   39    33    60    61   0.27300  1.0 3.0
   39    33    60    62   0.15000  1.0 3.0
IPHI
    9     5     7     8  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    34    35  10.50000 -1.0 2.0
END
