* LIGAND DATABASE FILE (OPLS2005)
*
001      60    60    109    167     323
    1     0 S   NP   _N1_     1    28.83185    93.50503   -20.62183
    2     1 S   H    _HN1     2     1.02776    86.66949   -74.66089
    3     1 S   H    _H1_     3     1.02964   100.27223    33.36853
    4     1 S   H    _H2_     4     1.02838    26.33110   141.11955
    5     1 S   CT   _CA1     5     1.50107   135.21581   166.66963
    6     5 S   HC   _HA1     6     1.09563   105.30861    47.40567
    7     5 S   CO3  _C1_     7     1.53844   112.28242   -73.00527
    8     7 S   O2Z  _O11     8     1.26360   115.00335   -44.50221
    9     7 S   O2Z  _O12     9     1.26231   114.95889   134.80084
   10     5 S   CT   _CB1    10     1.53096   107.44664   165.49148
   11    10 S   HC   HB11    11     1.09817   109.57727   -49.21979
   12    10 S   HC   HB12    12     1.09836   110.29641    67.38143
   13    10 S   CT   _CG1    13     1.53024   112.63768  -170.32230
   14    13 S   HC   HG11    14     1.09498   110.34129   -57.66347
   15    13 S   HC   HG12    15     1.09613   110.21621    61.42854
   16    13 S   C    _CD1    16     1.51781   111.99069  -178.39319
   17    16 S   O    _OE1    17     1.22747   123.06706   -15.86584
   18    16 S   N    _N2_    18     1.38593   111.82800   164.81202
   19    18 S   H    _HN2    19     1.01579   119.07769     1.70031
   20    18 S   CT1  _CA2    20     1.46273   123.35718  -176.82553
   21    20 S   HC   _HA2    21     1.09732   109.37555   -15.15815
   22    20 S   C    _C2_    22     1.53371   108.29773  -130.97817
   23    22 S   O    _O2_    23     1.23007   122.27758  -145.35534
   24    20 S   CT   _CB2    32     1.53642   111.26558   106.90944
   25    24 S   HC   HB21    33     1.09303   109.15161    56.35984
   26    24 S   HC   HB22    34     1.09491   110.19024   174.83669
   27    22 S   N    _N3_    24     1.38519   113.31634    41.96733
   28    27 S   H    _HN3    25     1.01532   118.91065    -0.50397
   29    24 S   S    _SG2    35     1.82896   111.27753   -65.90142
   30    27 S   CT   _CA3    26     1.45444   123.40300   175.15253
   31    30 S   HC   HA31    27     1.09526   109.18490    25.37003
   32    30 S   HC   HA32    28     1.09494   107.13486   142.36482
   33    29 S   CT   _C12    36     1.86919   102.69278   160.44017
   34    30 S   CO3  _C3_    29     1.52927   113.15184   -98.07113
   35    34 S   O2Z  _O31    30     1.26399   115.42049   -44.19420
   36    34 S   O2Z  _O32    31     1.26357   114.97207   136.74929
   37    33 S   CT   _C8_    37     1.55168   110.42130   -68.07751
   38    37 S   HC   _H18    38     1.09976   108.95036   175.41614
   39    37 S   HC   _H19    39     1.09561   111.27969    60.40861
   40    33 S   CT   _C13    57     1.53958   109.44909    52.18935
   41    40 S   HC   _H24    58     1.09531   112.41806    52.53405
   42    40 S   HC   _H25    59     1.09537   111.96467   -68.98268
   43    40 S   HC   _H26    60     1.09654   110.60852   172.47749
   44    37 S   CM   _C4_    40     1.51572   113.00633   -65.46481
   45    44 S   CT   _C10    41     1.52233   113.97128   -56.08631
   46    45 S   HC   _H22    42     1.09994   106.46427   -63.98581
   47    44 S   CM   _C5_    54     1.34372   120.21556   124.55026
   48    47 S   HC   _H14    55     1.08426   122.60997   179.40620
   49    47 S   HC   _H15    56     1.08547   121.18251    -0.46140
   50    45 S   CT   _C9_    43     1.54221   110.52244    52.43844
   51    50 S   HC   _H20    44     1.09840   110.22764    72.22706
   52    50 S   HC   _H21    45     1.09905   108.89268  -171.97845
   53    45 S   CM   _C6_    49     1.51122   114.65359   176.03711
   54    53 S   HC   _H16    50     1.08882   117.15731   -64.66613
   55    33 S   CT   _C11    46     1.56345   109.97811   173.62520
   56    55 S   Cl   CL13    47     1.79701   113.48226   -59.84311
   57    55 S   HC   _H23    48     1.09767   108.19627  -175.20466
   58    53 S   CM   _C7_    51     1.33640   123.50777   115.51999
   59    58 S   Cl   CL12    52     1.71283   122.92390   179.91607
   60    58 S   HC   _H17    53     1.08171   124.52898    -0.19782
  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
  16   2   1   1  17   6   5   8   3   2   1  12  15   8   4   1
   1   8   5   4   5   3   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    55    40    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    44    50    55    56    57    40    41    42    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    44    45    50    51    52    55    56    57    47    40    41    42    43  
   35    36  
   36  
    0  
   38    39    44    45    46    50    55    56    57    53    47    48    49    40    41    42    43  
   39    44    45    55    47    40  
   44    45    55    47    40  
   41    42    43    44    50    55    56    57  
   42    43    55  
   43    55  
   55  
   45    46    50    51    52    55    53    54    58    47    48    49  
   46    50    51    52    55    56    57    53    54    58    59    60    47    48    49  
   50    51    52    55    53    54    58    47  
   48    49    50    53  
   49  
    0  
   51    52    55    56    57    53    54    58  
   52    55    56    57    53  
   55    56    57    53  
   54    58    59    60    55  
   58    59    60  
   56    57  
   57  
    0  
   59    60  
   60  
    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   0.167500   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  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   38   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   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   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.120000   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   54   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   56   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   57   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5500   0.0760   0.005000   2.0020   1.7750   0.023028004  -0.852763146
   59   3.4000   0.3000  -0.120000   2.1950   1.9500   0.001000000   0.320982824
   60   2.4200   0.0300   0.115000   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   268.000  1.529
   33    55   268.000  1.529
   33    40   268.000  1.529
   37    38   340.000  1.090
   37    39   340.000  1.090
   37    44   317.000  1.510
   44    45   317.000  1.510
   44    47   549.000  1.340
   45    46   340.000  1.090
   45    50   268.000  1.529
   45    53   317.000  1.510
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    55   268.000  1.529
   55    56   245.000  1.781
   55    57   340.000  1.090
   53    54   340.000  1.080
   53    58   549.000  1.340
   58    59   300.000  1.725
   58    60   340.000  1.080
   47    48   340.000  1.080
   47    49   340.000  1.080
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    43   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    55    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    37    38    37.50000  110.70000
   33    37    39    37.50000  110.70000
   33    37    44    70.00000  112.02700
   33    55    50    58.35000  112.70000
   33    55    56    69.00000  109.80000
   33    55    57    37.50000  110.70000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    43    37.50000  110.70000
   37    44    45    65.00000  117.92700
   37    44    47    70.00000  124.00000
   39    37    38    33.00000  107.80000
   44    37    38    35.00000  109.50000
   44    37    39    35.00000  109.50000
   44    45    46    35.00000  109.50000
   44    45    50    70.00000  112.02700
   44    45    53    70.00000  110.12100
   44    47    48    35.00000  120.00000
   44    47    49    35.00000  120.00000
   45    50    51    37.50000  110.70000
   45    50    52    37.50000  110.70000
   45    50    55    58.35000  112.70000
   45    53    54    35.00000  117.00000
   45    53    58    70.00000  124.00000
   50    45    46    37.50000  110.70000
   50    55    56    69.00000  109.80000
   50    55    57    37.50000  110.70000
   52    50    51    33.00000  107.80000
   55    33    37    58.35000  112.70000
   55    50    51    37.50000  110.70000
   55    50    52    37.50000  110.70000
   57    55    56    51.00000  107.60000
   53    45    46    35.00000  109.50000
   53    45    50    70.00000  112.02700
   53    58    59    75.00000  121.50000
   53    58    60    35.00000  120.00000
   58    53    54    35.00000  120.00000
   60    58    59    60.00000  114.00000
   47    44    45    70.00000  124.00000
   49    47    48    35.00000  117.00000
   40    33    37    58.35000  112.70000
   40    33    55    58.35000  112.70000
   42    40    41    33.00000  107.80000
   43    40    41    33.00000  107.80000
   43    40    42    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    55   0.01700  1.0 1.0
   24    29    33    55  -0.23550 -1.0 2.0
   24    29    33    55   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    37    38   0.15000  1.0 3.0
   29    33    37    39   0.15000  1.0 3.0
   29    33    37    44   0.56750  1.0 1.0
   29    33    37    44  -0.07550 -1.0 2.0
   29    33    37    44   0.20000  1.0 3.0
   29    33    55    50   0.44750  1.0 1.0
   29    33    55    50  -0.17800 -1.0 2.0
   29    33    55    50   0.20200  1.0 3.0
   29    33    55    56   0.56750  1.0 1.0
   29    33    55    56  -0.07550 -1.0 2.0
   29    33    55    56   0.20000  1.0 3.0
   29    33    55    57   0.15000  1.0 3.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    43   0.15000  1.0 3.0
   33    37    44    45   0.46850  1.0 1.0
   33    37    44    45   0.08550 -1.0 2.0
   33    37    44    45   0.09800  1.0 3.0
   33    37    44    47   0.09850  1.0 1.0
   33    37    44    47   0.15250 -1.0 2.0
   33    37    44    47  -0.50650  1.0 3.0
   37    33    55    50   0.56750  1.0 1.0
   37    33    55    50  -0.07550 -1.0 2.0
   37    33    55    50   0.20000  1.0 3.0
   37    33    55    56   0.35600  1.0 1.0
   37    33    55    56  -0.14650 -1.0 2.0
   37    33    55    56   0.33350  1.0 3.0
   37    33    55    57   0.15000  1.0 3.0
   37    33    40    41   0.15000  1.0 3.0
   37    33    40    42   0.15000  1.0 3.0
   37    33    40    43   0.15000  1.0 3.0
   37    44    45    46   0.34800  1.0 3.0
   37    44   -45    50   0.46850  1.0 1.0
   37    44   -45    50   0.08550 -1.0 2.0
   37    44   -45    50   0.09800  1.0 3.0
   37    44    45    53   0.09700  1.0 1.0
   37    44    45    53   0.15600 -1.0 2.0
   37    44    45    53  -0.50800  1.0 3.0
   37    44    47    48   7.00000 -1.0 2.0
   37    44    47    49   7.00000 -1.0 2.0
   38    37    44    45   0.34800  1.0 3.0
   38    37    44    47   0.00000  1.0 1.0
   39    37    44    45   0.34800  1.0 3.0
   39    37    44    47   0.00000  1.0 1.0
   44    45    50    51   0.15000  1.0 3.0
   44    45    50    52   0.15000  1.0 3.0
   44    45    50    55   0.34400  1.0 1.0
   44    45    50    55   0.09450 -1.0 2.0
   44    45    50    55   0.11100  1.0 3.0
   44    45    53    54   0.00000  1.0 1.0
   44    45    53    58  -0.28300  1.0 1.0
   44    45    53    58   0.26700 -1.0 2.0
   44    45    53    58  -0.63300  1.0 3.0
   45    44    47    48   7.00000 -1.0 2.0
   45    44    47    49   7.00000 -1.0 2.0
   45    50   -55    33   0.56750  1.0 1.0
   45    50   -55    33  -0.07550 -1.0 2.0
   45    50   -55    33   0.20000  1.0 3.0
   45    50    55    56   0.35600  1.0 1.0
   45    50    55    56  -0.14650 -1.0 2.0
   45    50    55    56   0.33350  1.0 3.0
   45    50    55    57   0.15000  1.0 3.0
   45    53    58    59   7.00000 -1.0 2.0
   45    53    58    60   7.00000 -1.0 2.0
   46    45    50    51   0.15000  1.0 3.0
   46    45    50    52   0.15000  1.0 3.0
   46    45    50    55   0.15000  1.0 3.0
   46    45    53    54   0.33100  1.0 3.0
   46    45    53    58   0.00000  1.0 1.0
   50    45    53    54   0.00000  1.0 1.0
   50    45    53    58   0.09850  1.0 1.0
   50    45    53    58   0.15250 -1.0 2.0
   50    45    53    58  -0.50650  1.0 3.0
   51    50    55    33   0.15000  1.0 3.0
   51    50    55    56   0.27000  1.0 3.0
   51    50    55    57   0.15000  1.0 3.0
   52    50    55    33   0.15000  1.0 3.0
   52    50    55    56   0.27000  1.0 3.0
   52    50    55    57   0.15000  1.0 3.0
   55    33    37    38   0.15000  1.0 3.0
   55    33    37    39   0.15000  1.0 3.0
   55    33   -37    44   0.34400  1.0 1.0
   55    33   -37    44   0.09450 -1.0 2.0
   55    33   -37    44   0.11100  1.0 3.0
   55    33    40    41   0.15000  1.0 3.0
   55    33    40    42   0.15000  1.0 3.0
   55    33    40    43   0.15000  1.0 3.0
   53    45    50    51   0.15000  1.0 3.0
   53    45    50    52   0.15000  1.0 3.0
   53    45    50    55   0.34400  1.0 1.0
   53    45    50    55   0.09450 -1.0 2.0
   53    45    50    55   0.11100  1.0 3.0
   54    53    58    59   7.00000 -1.0 2.0
   54    53    58    60   7.00000 -1.0 2.0
   47    44    45    46   0.00000  1.0 1.0
   47    44    45    50   0.09850  1.0 1.0
   47    44    45    50   0.15250 -1.0 2.0
   47    44    45    50  -0.50650  1.0 3.0
   47    44    45    53  -0.28300  1.0 1.0
   47    44    45    53   0.26700 -1.0 2.0
   47    44    45    53  -0.63300  1.0 3.0
   40    33    37    38   0.15000  1.0 3.0
   40    33    37    39   0.15000  1.0 3.0
   40    33    37    44   0.34400  1.0 1.0
   40    33    37    44   0.09450 -1.0 2.0
   40    33    37    44   0.11100  1.0 3.0
   40    33    55    50   0.56750  1.0 1.0
   40    33    55    50  -0.07550 -1.0 2.0
   40    33    55    50   0.20000  1.0 3.0
   40    33    55    56   0.35600  1.0 1.0
   40    33    55    56  -0.14650 -1.0 2.0
   40    33    55    56   0.33350  1.0 3.0
   40    33    55    57   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
   37    45    44    47   1.10000 -1.0 2.0
   45    54    53    58  15.00000 -1.0 2.0
   59    60    58    53  15.00000 -1.0 2.0
   48    49    47    44   1.10000 -1.0 2.0
END
