* LIGAND DATABASE FILE (OPLS2005)
*
001      59    59    101    153     295
    1     0 S   NP   _N1_     1    28.83286    97.16383   -23.34700
    2     1 S   H    _HN1     2     1.02828    36.47212   155.62089
    3     1 S   H    _H1_     3     1.02790   109.99085  -111.04267
    4     1 S   H    _H2_     4     1.02952    72.06372    -7.51322
    5     1 S   CT   _CA1     5     1.50124   133.85705    93.84564
    6     5 S   HC   _HA1     6     1.09573   105.20047    93.18881
    7     5 S   CO3  _C1_     7     1.53762   112.45930   -27.04912
    8     7 S   O2Z  _O11     8     1.26368   115.00144   -42.90093
    9     7 S   O2Z  _O12     9     1.26238   114.93746   136.20354
   10     5 S   CT   _CB1    10     1.53053   107.39677  -148.86376
   11    10 S   HC   HB11    11     1.09836   109.30739   -50.06896
   12    10 S   HC   HB12    12     1.09817   110.44510    66.48237
   13    10 S   CT   _CG1    13     1.53023   112.69370  -171.08983
   14    13 S   HC   HG11    14     1.09581   110.62365   -66.02461
   15    13 S   HC   HG12    15     1.09660   109.83691    53.25721
   16    13 S   C    _CD1    16     1.51781   112.10164   173.65211
   17    16 S   O    _OE1    17     1.22753   123.15761     6.28772
   18    16 S   N    _N2_    18     1.38596   111.80661  -173.98562
   19    18 S   H    _HN2    19     1.01556   119.14149     2.73008
   20    18 S   CT1  _CA2    20     1.46040   122.79032   176.50677
   21    20 S   HC   _HA2    21     1.09443   109.84966    17.34824
   22    20 S   C    _C2_    22     1.52836   104.39709   -99.13393
   23    22 S   O    _O2_    23     1.23007   122.65584   -91.11887
   24    20 S   CT   _CB2    32     1.53179   111.59168   141.17179
   25    24 S   HC   HB21    33     1.09659   110.02983    54.69946
   26    24 S   HC   HB22    34     1.09458   111.07847   172.11091
   27    22 S   N    _N3_    24     1.38553   112.85719    84.31489
   28    27 S   H    _HN3    25     1.01690   119.80949     3.00869
   29    24 S   S    _SG2    35     1.83027   113.25906   -63.89043
   30    27 S   CT   _CA3    26     1.45320   122.68076  -178.04686
   31    30 S   HC   HA31    27     1.09555   107.03955   -74.53458
   32    30 S   HC   HA32    28     1.09562   108.50953    41.85744
   33    29 S   CT   _C10    36     1.84806   100.55153   -75.08814
   34    33 S   HC   _H3_    37     1.08987   105.81971    44.69140
   35    30 S   CO3  _C3_    29     1.52894   114.55704   164.04409
   36    35 S   O2Z  _O31    30     1.26303   116.28524    -6.20953
   37    35 S   O2Z  _O32    31     1.26492   114.33205   174.13790
   38    33 S   CA   _C7_    38     1.52523   109.95231   161.44307
   39    33 S   CM   _C11    53     1.51476   109.34953   -73.95124
   40    39 S   HC   _H7_    54     1.09152   115.38749   -55.04425
   41    38 S   CA   _C8_    39     1.40742   121.16158    69.31528
   42    41 S   HA   _H6_    40     1.08735   120.11626     0.27052
   43    39 S   CMA  _C12    55     1.35014   128.37579   124.17156
   44    43 S   OM   _O38    56     1.26204   131.53101  -179.32045
   45    41 S   CA   _C9_    41     1.39935   120.42313  -179.61437
   46    43 S   CO3  _C13    57     1.55440   115.32941     0.72954
   47    46 S   O2Z  _O37    58     1.26728   115.36132    89.54123
   48    46 S   O2Z  _O36    59     1.26771   115.24255   -89.12278
   49    45 S   CA   _C4_    42     1.39226   121.20918     0.27836
   50    49 S   HA   _H4_    43     1.08520   121.71088  -179.95577
   51    45 S   SY   _S1_    49     1.79745   118.50687   178.98973
   52    51 S   OY   _O35    50     1.46043   103.76969  -165.35493
   53    51 S   OY   _O33    51     1.46044   102.60443   -45.68958
   54    51 S   OY   _O34    52     1.45970   101.83129    74.56424
   55    49 S   CA   _C5_    44     1.39236   119.04405     0.01978
   56    55 S   HA   _H5_    45     1.08644   119.17767   179.76930
   57    38 S   CA   _C6_    46     1.40664   121.15025  -109.63851
   58    57 S   OH   _O39    47     1.37018   119.41778     0.08393
   59    58 S   HO   _H8_    48     0.97155   109.10627  -177.89904
  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   8   5   4   3
  13   6   2   1   1  13   8   3  11   4   4   3   9   2   1   1
   9   4   4   2   1   1   4   2   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    41    57    39    40    43  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    41    42    45    55    57    58    39    40    43    44    46  
   38    41    57    39    40    43  
   36    37  
   37  
    0  
   41    42    45    49    55    56    57    58    59    51    39    40    43  
   40    43    44    46    47    48    41    57  
   43    44    46  
   42    45    49    50    55    57    58    51    52    53    54  
   45    49    57    51  
   44    46    47    48  
   46    47    48  
   49    50    55    56    57    51    52    53    54  
   47    48  
   48  
    0  
   50    55    56    57    58    51    52    53    54  
   55    56    57    51  
   52    53    54    55  
   53    54  
   54  
    0  
   56    57    58    59  
   57    58  
   58    59  
   59  
    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   0.222500   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0760  -0.716200   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   42   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   43   3.5500   0.0760   0.375100   2.0020   1.7750   0.023028004  -0.852763146
   44   3.1500   0.2500  -0.773900   1.7825   1.5750   0.001000000  -0.126889456
   45   3.5500   0.0700   0.007500   2.5000   1.7750   0.001000000  -0.843144165
   46   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   47   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   48   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.2500   1.291800   2.0025   1.7750   0.025682759  -1.666211680
   52   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   53   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   54   2.9600   0.1700  -0.766433   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   58   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   59   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
BOND
    1     2   434.000  1.010
    1     3   434.000  1.010
    1     4   434.000  1.010
    1     5   367.000  1.471
    5     6   340.000  1.090
    5     7   317.000  1.522
    5    10   268.000  1.529
    7     8   656.000  1.250
    7     9   656.000  1.250
   10    11   340.000  1.090
   10    12   340.000  1.090
   10    13   268.000  1.529
   13    14   340.000  1.090
   13    15   340.000  1.090
   13    16   317.000  1.522
   16    17   570.000  1.229
   16    18   490.000  1.335
   18    19   434.000  1.010
   18    20   337.000  1.449
   20    21   340.000  1.090
   20    22   317.000  1.522
   20    24   268.000  1.529
   22    23   570.000  1.229
   22    27   490.000  1.335
   27    28   434.000  1.010
   27    30   337.000  1.449
   30    31   340.000  1.090
   30    32   340.000  1.090
   30    35   317.000  1.522
   35    36   656.000  1.250
   35    37   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    38   317.000  1.510
   33    39   317.000  1.510
   38    41   469.000  1.400
   38    57   469.000  1.400
   41    42   367.000  1.080
   41    45   469.000  1.400
   45    49   469.000  1.400
   45    51   225.000  1.779
   49    50   367.000  1.080
   49    55   469.000  1.400
   55    56   367.000  1.080
   55    57   469.000  1.400
   57    58   450.000  1.364
   58    59   553.000  0.945
   51    52   735.000  1.471
   51    53   735.000  1.471
   51    54   735.000  1.471
   39    40   340.000  1.080
   39    43   465.000  1.376
   43    44   745.000  1.250
   43    46   230.000  1.545
   46    47   656.000  1.250
   46    48   656.000  1.250
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    80.00000  109.48900
   29    33    39    75.00000  112.20000
   33    38    41    70.00000  120.00000
   33    38    57    70.00000  120.00000
   33    39    40    35.00000  117.00000
   33    39    43    70.00000  124.00000
   38    33    34    35.00000  109.50000
   38    41    42    35.00000  120.00000
   38    41    45    63.00000  120.00000
   38    57    55    63.00000  120.00000
   38    57    58    70.00000  120.00000
   41    45    49    63.00000  120.00000
   41    45    51    65.00000  117.06700
   45    41    42    35.00000  120.00000
   45    49    50    35.00000  120.00000
   45    49    55    63.00000  120.00000
   45    51    52   100.00000  107.67100
   45    51    53   100.00000  107.67100
   45    51    54   100.00000  107.67100
   49    55    56    35.00000  120.00000
   49    55    57    63.00000  120.00000
   55    49    50    35.00000  120.00000
   55    57    58    70.00000  120.00000
   57    38    41    63.00000  120.00000
   57    55    56    35.00000  120.00000
   57    58    59    35.00000  113.00000
   51    45    49    65.00000  117.06700
   53    51    52   115.00000  120.17200
   54    51    52   115.00000  120.17200
   54    51    53   115.00000  120.17200
   39    33    34    35.00000  109.50000
   39    33    38    70.00000  112.99600
   39    43    44    65.00000  137.10300
   39    43    46    55.00000  124.75400
   43    39    40    40.00000  120.50800
   43    46    47    85.00000  113.83300
   43    46    48    85.00000  113.83300
   46    43    44    65.00000  121.00000
   48    46    47    80.00000  126.00000
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  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39  -0.62250  1.0 1.0
   24    29    33    39  -0.38450 -1.0 2.0
   24    29    33    39   0.81900  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    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    38    57  -0.16000  1.0 1.0
   29    33    38    57  -0.03200 -1.0 2.0
   29    33    38    57   0.04500  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    43   0.42700  1.0 1.0
   29    33    39    43  -0.70350 -1.0 2.0
   29    33    39    43  -0.43150  1.0 3.0
   33    38    41    42   3.62500 -1.0 2.0
   33    38    41    45   3.62500 -1.0 2.0
   33    38    57    55   3.62500 -1.0 2.0
   33    38    57    58   3.62500 -1.0 2.0
   33    39    43    44   7.00000 -1.0 2.0
   33    39    43    46   7.00000 -1.0 2.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    38    57   0.00000  1.0 1.0
   34    33    39    40   0.33100  1.0 3.0
   34    33    39    43   0.00000  1.0 1.0
   38    33    39    40   0.00000  1.0 1.0
   38    33    39    43   1.44450  1.0 1.0
   38    33    39    43   0.06600 -1.0 2.0
   38    33    39    43   0.29250  1.0 3.0
   38    41    45    49   3.62500 -1.0 2.0
   38    41    45    51   3.62500 -1.0 2.0
   38    57    58    59   0.84100 -1.0 2.0
   41    38    57    55   3.62500 -1.0 2.0
   41    38    57    58   3.62500 -1.0 2.0
   41    45    49    50   3.62500 -1.0 2.0
   41    45   -49    55   3.62500 -1.0 2.0
   41    45    51    52   0.19500  1.0 1.0
   41    45    51    52   0.12000 -1.0 2.0
   41    45    51    53   0.19500  1.0 1.0
   41    45    51    53   0.12000 -1.0 2.0
   41    45    51    54   0.19500  1.0 1.0
   41    45    51    54   0.12000 -1.0 2.0
   42    41    45    49   3.62500 -1.0 2.0
   42    41    45    51   3.62500 -1.0 2.0
   45    49    55    56   3.62500 -1.0 2.0
   45    49    55    57   3.62500 -1.0 2.0
   49    45    51    52   0.19500  1.0 1.0
   49    45    51    52   0.12000 -1.0 2.0
   49    45    51    53   0.19500  1.0 1.0
   49    45    51    53   0.12000 -1.0 2.0
   49    45    51    54   0.19500  1.0 1.0
   49    45    51    54   0.12000 -1.0 2.0
   49    55   -57    38   3.62500 -1.0 2.0
   49    55    57    58   3.62500 -1.0 2.0
   50    49    55    56   3.62500 -1.0 2.0
   50    49    55    57   3.62500 -1.0 2.0
   55    57    58    59   0.84100 -1.0 2.0
   56    55    57    38   3.62500 -1.0 2.0
   56    55    57    58   3.62500 -1.0 2.0
   57    38    41    42   3.62500 -1.0 2.0
   57    38   -41    45   3.62500 -1.0 2.0
   51    45    49    50   3.62500 -1.0 2.0
   51    45    49    55   3.62500 -1.0 2.0
   39    33    38    41   0.18050 -1.0 2.0
   39    33    38    57   0.18050 -1.0 2.0
   39    43    46    47  -0.04000 -1.0 2.0
   39    43    46    47  -0.29050  1.0 3.0
   39    43    46    48  -0.04000 -1.0 2.0
   39    43    46    48  -0.29050  1.0 3.0
   40    39    43    44   7.00000 -1.0 2.0
   40    39    43    46   7.00000 -1.0 2.0
   44    43    46    47   1.68800 -1.0 2.0
   44    43    46    48   1.68800 -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
   41    57    38    33   4.00000 -1.0 2.0
   45    42    41    38   1.10000 -1.0 2.0
   49    51    45    41   4.00000 -1.0 2.0
   55    50    49    45   1.10000 -1.0 2.0
   57    56    55    49   1.10000 -1.0 2.0
   55    58    57    38   4.00000 -1.0 2.0
   33    40    39    43  15.00000 -1.0 2.0
   46    44    43    39  15.00000 -1.0 2.0
   47    43    46    48  10.50000 -1.0 2.0
END
