* LIGAND DATABASE FILE (OPLS2005)
*
001      58    59    107    165     312
    1     0 S   NP   _N1_     1    28.78867    96.03054   -23.66911
    2     1 S   H    _HN1     2     1.02786   106.90896   -92.99220
    3     1 S   H    _H1_     3     1.02949    73.80885    11.76072
    4     1 S   H    _H2_     4     1.02828    35.74787   169.69662
    5     1 S   CT   _CA1     5     1.50108   136.16663   114.57815
    6     5 S   HC   _HA1     6     1.09572   105.19816    90.08001
    7     5 S   CO3  _C1_     7     1.53785   112.48039   -30.17172
    8     7 S   O2Z  _O11     8     1.26372   115.00803   -42.37788
    9     7 S   O2Z  _O12     9     1.26240   114.94579   136.78977
   10     5 S   CT   _CB1    10     1.53080   107.42436  -151.92182
   11    10 S   HC   HB11    11     1.09833   109.37478   -49.67116
   12    10 S   HC   HB12    12     1.09813   110.44643    66.93710
   13    10 S   CT   _CG1    13     1.52992   112.60726  -170.64369
   14    13 S   HC   HG11    14     1.09580   110.64847   -65.75758
   15    13 S   HC   HG12    15     1.09671   109.77317    53.47809
   16    13 S   C    _CD1    16     1.51796   112.20708   173.94631
   17    16 S   O    _OE1    17     1.22731   123.28533     7.62946
   18    16 S   N    _N2_    18     1.38656   111.68723  -172.49737
   19    18 S   H    _HN2    19     1.01587   118.91751     1.79155
   20    18 S   CT1  _CA2    20     1.46202   123.37774   177.25733
   21    20 S   HC   _HA2    21     1.09738   109.39040     3.07129
   22    20 S   C    _C2_    22     1.53580   108.57414  -112.39172
   23    22 S   O    _O2_    23     1.23056   122.27057  -147.80547
   24    20 S   CT   _CB2    32     1.53476   111.57438   125.13160
   25    24 S   HC   HB21    33     1.09441   109.54454    56.61967
   26    24 S   HC   HB22    34     1.09413   109.61742   175.27275
   27    22 S   N    _N3_    24     1.38322   113.71690    39.62408
   28    27 S   H    _HN3    25     1.01580   119.59928    -3.26027
   29    24 S   S    _SG2    35     1.83203   111.07687   -64.97481
   30    27 S   CT   _CA3    26     1.45290   123.23347   177.17818
   31    30 S   HC   HA31    27     1.09549   107.50525   -64.80502
   32    30 S   HC   HA32    28     1.09555   107.99717    51.64444
   33    29 S   CT   _C12    36     1.84958   101.83423   173.88669
   34    33 S   Cl   Cl1_    37     1.79086   109.76552   -62.90783
   35    33 S   Cl   Cl2_    38     1.78988   110.16952    57.90447
   36    30 S   CO3  _C3_    29     1.52967   114.05814   173.64556
   37    36 S   O2Z  _O31    30     1.26379   116.05925    -0.65282
   38    36 S   O2Z  _O32    31     1.26426   114.41921   179.40818
   39    33 S   S    _S1_    39     1.84602   106.89863   177.56844
   40    39 S   N    _N4_    40     1.68690   102.34890   178.64376
   41    40 S   C    _C10    41     1.38197   122.94984   -96.52929
   42    41 S   O    _O33    42     1.22287   128.88525     7.26226
   43    40 S   C    _C11    57     1.38253   123.23541    91.79039
   44    43 S   O    _O34    58     1.22139   128.82232     4.93705
   45    41 S   CT   _C9_    43     1.51465   106.85110  -167.85618
   46    45 S   HC   _H4_    44     1.09566   109.96172  -138.76124
   47    45 S   CT   _C4_    45     1.53710   108.22931   100.06736
   48    47 S   HC   _H5_    46     1.09748   108.17500    96.60111
   49    47 S   HC   _H6_    47     1.09794   111.22431   -18.92063
   50    47 S   CM   _C5_    48     1.49371   115.28022  -141.75988
   51    50 S   HC   _H7_    49     1.08692   117.13483  -171.22031
   52    50 S   CM   _C6_    50     1.33678   123.95216     9.07822
   53    52 S   HC   _H8_    51     1.08686   118.98062  -179.32103
   54    52 S   CT   _C7_    52     1.49401   123.82146     0.03956
   55    54 S   HC   _H9_    53     1.09602   108.79494   134.93385
   56    54 S   HC   _H10    54     1.09742   107.10912  -110.37954
   57    45 S   CT   _C8_    55     1.53253   102.23409   -21.72168
   58    57 S   HC   _H3_    56     1.10046   109.20506   -81.27552
  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   5   5   4   3
   6   3   2   2   1   1   7  10  12   5  10   4  12   7   9   5
   4   7   3   6   4   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    36    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    35    39    27  
   26    29    33  
   29    33  
   28    30    31    32    36    37    38  
   30    31    32    36  
   33    34    35    39    40  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    43  
   35    39    40  
   39    40  
   37    38  
   38  
    0  
   40    41    42    45    57    43    44  
   41    42    45    46    47    54    57    58    43    44  
   42    45    46    47    48    49    50    54    57    58    43    44  
   45    46    47    57    43  
   44    45    46    47    52    54    55    56    57    58  
   45    54    57    58  
   46    47    48    49    50    51    52    54    55    56    57    58  
   47    48    49    50    54    57    58  
   48    49    50    51    52    53    54    57    58  
   49    50    51    52    57  
   50    51    52    57  
   51    52    53    54    55    56    57  
   52    53    54  
   53    54    55    56    57    58  
   54    55    56    57  
   55    56    57    58  
   56    57    58  
   57    58  
   58  
    0  
NBON
    1   3.2500   0.1700   0.247500   2.2900   2.0360   0.003973653   1.685851020
    2   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    3   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    4   0.5000   0.0300   0.210000   0.9960   0.8600   0.030040813  -0.651083722
    5   3.5000   0.0660   0.062500   1.9750   1.7500   0.005000000  -0.741685710
    6   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
    7   3.7500   0.1050   0.445000   2.1120   1.8750   0.001000000  -0.126889456
    8   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
    9   3.1500   0.2500  -0.722500   1.7000   1.5000   0.001000000  -0.126889456
   10   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   11   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   12   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   13   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   14   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   15   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   16   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   17   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   18   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   19   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   20   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   21   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   22   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   23   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   24   3.5000   0.0660   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   25   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   26   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   27   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   28   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   29   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   30   3.5000   0.0660  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   31   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   32   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   33   3.5000   0.0660   0.286600   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   35   3.4000   0.3000  -0.135800   2.1950   1.9500   0.001000000   0.320982824
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.6000   0.3550   0.107500   2.0300   1.8000   0.025682759  -1.666211680
   40   3.2500   0.1700  -0.240000   1.8100   1.6000   0.054801302  -1.445846770
   41   3.7500   0.1050   0.570500   1.9250   1.7000   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   43   3.7500   0.1050   0.570500   1.9250   1.7000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.508000   1.5250   1.4250   0.001000000  -1.480495490
   45   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   51   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   52   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   53   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   245.000  1.781
   33    35   245.000  1.781
   33    39   222.000  1.810
   39    40   230.000  1.714
   40    41   490.000  1.335
   40    43   490.000  1.335
   41    42   570.000  1.229
   41    45   317.000  1.522
   45    46   340.000  1.090
   45    47   268.000  1.529
   45    57   268.000  1.529
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   317.000  1.510
   50    51   340.000  1.080
   50    52   549.000  1.340
   52    53   340.000  1.080
   52    54   317.000  1.510
   54    55   340.000  1.090
   54    56   340.000  1.090
   54    57   268.000  1.529
   57    58   340.000  1.090
   57    43   317.000  1.522
   43    44   570.000  1.229
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    85.00000  110.65400
   29    33    35    85.00000  110.65400
   29    33    39    75.00000  118.28000
   33    39    40   100.00000   97.00000
   35    33    34    80.00000  110.42200
   39    33    34    85.00000  110.65400
   39    33    35    85.00000  110.65400
   39    40    41    75.00000  121.67400
   39    40    43    75.00000  121.67400
   40    41    42    80.00000  122.90000
   40    41    45    70.00000  116.60000
   40    43    57    70.00000  116.60000
   40    43    44    80.00000  122.90000
   41    45    46    35.00000  109.50000
   41    45    47    63.00000  111.10000
   41    45    57    63.00000  111.10000
   45    41    42    80.00000  120.40000
   45    47    48    37.50000  110.70000
   45    47    49    37.50000  110.70000
   45    47    50    70.00000  112.02700
   45    57    54    58.35000  112.70000
   45    57    58    37.50000  110.70000
   45    57    43    63.00000  111.10000
   47    45    46    37.50000  110.70000
   47    50    51    35.00000  117.00000
   47    50    52    70.00000  124.00000
   49    47    48    33.00000  107.80000
   50    47    48    35.00000  109.50000
   50    47    49    35.00000  109.50000
   50    52    53    35.00000  120.00000
   50    52    54    70.00000  124.00000
   52    50    51    35.00000  120.00000
   52    54    55    35.00000  109.50000
   52    54    56    35.00000  109.50000
   52    54    57    70.00000  112.02700
   54    52    53    35.00000  117.00000
   54    57    58    37.50000  110.70000
   54    57    43    63.00000  111.10000
   56    54    55    33.00000  107.80000
   57    45    46    37.50000  110.70000
   57    45    47    58.35000  112.70000
   57    54    55    37.50000  110.70000
   57    54    56    37.50000  110.70000
   57    43    44    80.00000  120.40000
   43    40    41    70.00000  121.37400
   43    57    58    35.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    36    37   0.00000  1.0 1.0
   27    30    36    38   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  1.0 3.0
   24    29    33    35   0.01700  1.0 1.0
   24    29    33    35  -0.23550 -1.0 2.0
   24    29    33    35   0.21350  1.0 3.0
   24    29    33    39   0.08500  1.0 1.0
   24    29    33    39  -0.53150 -1.0 2.0
   24    29    33    39   0.48050  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.08500  1.0 1.0
   29    33    39    40  -0.53150 -1.0 2.0
   29    33    39    40   0.48050  1.0 3.0
   33    39    40    41   0.00000  1.0 1.0
   33    39    40    43   0.00000  1.0 1.0
   34    33    39    40   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   39    40    41    42   2.45000 -1.0 2.0
   39    40    41    45   2.45000 -1.0 2.0
   39    40    43    57   2.45000 -1.0 2.0
   39    40    43    44   2.45000 -1.0 2.0
   40    41    45    46   0.00000  1.0 1.0
   40    41    45    47   1.39750  1.0 1.0
   40    41    45    47  -0.07950 -1.0 2.0
   40    41    45    47  -0.18750  1.0 3.0
   40    41   -45    57   1.39750  1.0 1.0
   40    41   -45    57  -0.07950 -1.0 2.0
   40    41   -45    57  -0.18750  1.0 3.0
   41    40   -43    57   2.45000 -1.0 2.0
   41    40    43    44   2.22250 -1.0 2.0
   41    45    47    48  -0.11250  1.0 3.0
   41    45    47    49  -0.11250  1.0 3.0
   41    45    47    50  -0.98800  1.0 1.0
   41    45    47    50   0.48800 -1.0 2.0
   41    45    47    50   0.76800  1.0 3.0
   41    45    57    54  -0.95700  1.0 1.0
   41    45    57    54  -0.18200 -1.0 2.0
   41    45    57    54   0.29450  1.0 3.0
   41    45    57    58  -0.11250  1.0 3.0
   41    45   -57    43   0.11950  1.0 1.0
   41    45   -57    43   0.20300 -1.0 2.0
   41    45   -57    43  -0.70800  1.0 3.0
   42    41    45    46   0.00000  1.0 1.0
   42    41    45    47   0.30150 -1.0 2.0
   42    41    45    57   0.30150 -1.0 2.0
   45    47    50    51   0.00000  1.0 1.0
   45    47    50    52   0.09850  1.0 1.0
   45    47    50    52   0.15250 -1.0 2.0
   45    47    50    52  -0.50650  1.0 3.0
   45    57   -43    40   1.39750  1.0 1.0
   45    57   -43    40  -0.07950 -1.0 2.0
   45    57   -43    40  -0.18750  1.0 3.0
   45    57    43    44   0.30150 -1.0 2.0
   46    45    47    48   0.15000  1.0 3.0
   46    45    47    49   0.15000  1.0 3.0
   46    45    47    50   0.15000  1.0 3.0
   46    45    57    54   0.15000  1.0 3.0
   46    45    57    58   0.15000  1.0 3.0
   46    45    57    43  -0.11250  1.0 3.0
   47    45    57    54   0.56750  1.0 1.0
   47    45    57    54  -0.07550 -1.0 2.0
   47    45    57    54   0.20000  1.0 3.0
   47    45    57    58   0.15000  1.0 3.0
   47    45    57    43  -0.95700  1.0 1.0
   47    45    57    43  -0.18200 -1.0 2.0
   47    45    57    43   0.29450  1.0 3.0
   47    50    52    53   7.00000 -1.0 2.0
   47    50   -52    54   7.00000 -1.0 2.0
   48    47    50    51   0.33100  1.0 3.0
   48    47    50    52   0.00000  1.0 1.0
   49    47    50    51   0.33100  1.0 3.0
   49    47    50    52   0.00000  1.0 1.0
   50    52    54    55   0.00000  1.0 1.0
   50    52    54    56   0.00000  1.0 1.0
   50    52    54    57   0.09850  1.0 1.0
   50    52    54    57   0.15250 -1.0 2.0
   50    52    54    57  -0.50650  1.0 3.0
   51    50    52    53   7.00000 -1.0 2.0
   51    50    52    54   7.00000 -1.0 2.0
   52    54   -57    45   0.34400  1.0 1.0
   52    54   -57    45   0.09450 -1.0 2.0
   52    54   -57    45   0.11100  1.0 3.0
   52    54    57    58   0.15000  1.0 3.0
   52    54    57    43  -0.98800  1.0 1.0
   52    54    57    43   0.48800 -1.0 2.0
   52    54    57    43   0.76800  1.0 3.0
   53    52    54    55   0.33100  1.0 3.0
   53    52    54    56   0.33100  1.0 3.0
   53    52    54    57   0.00000  1.0 1.0
   54    57    43    40   1.39750  1.0 1.0
   54    57    43    40  -0.07950 -1.0 2.0
   54    57    43    40  -0.18750  1.0 3.0
   54    57    43    44   0.30150 -1.0 2.0
   55    54    57    45   0.15000  1.0 3.0
   55    54    57    58   0.15000  1.0 3.0
   55    54    57    43  -0.11250  1.0 3.0
   56    54    57    45   0.15000  1.0 3.0
   56    54    57    58   0.15000  1.0 3.0
   56    54    57    43  -0.11250  1.0 3.0
   57    45    47    48   0.15000  1.0 3.0
   57    45    47    49   0.15000  1.0 3.0
   57    45   -47    50   0.34400  1.0 1.0
   57    45   -47    50   0.09450 -1.0 2.0
   57    45   -47    50   0.11100  1.0 3.0
   58    57    43    40   0.00000  1.0 1.0
   58    57    43    44   0.00000  1.0 1.0
   43    40    41    42   2.22250 -1.0 2.0
   43    40   -41    45   2.45000 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   43    41    40    39   1.00000 -1.0 2.0
   40    45    41    42  10.50000 -1.0 2.0
   47    51    50    52   1.10000 -1.0 2.0
   54    53    52    50   1.10000 -1.0 2.0
   40    57    43    44  10.50000 -1.0 2.0
END
