* LIGAND DATABASE FILE (OPLS2005)
*
001      55    54     91    137     271
    1     0 S   NP   _N1_     1    28.70111    93.89001   -20.80213
    2     1 S   H    _HN1     2     1.02039    92.24367    36.63080
    3     1 S   H    _H1_     3     1.02180    33.01958   158.50628
    4     1 S   H    _H2_     4     1.02121    88.17277   -72.00544
    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     1.08611   110.43906    58.92669
   26    24 S   HC   HB22    34     1.08603   109.84388   179.00397
   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   _C9_    36     1.86804   102.33666   159.99004
   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   CM   _C5_    37     1.52617   106.89984   159.97593
   38    37 S   HC   _H17    38     1.09066   115.12056  -113.81134
   39    33 S   CM   _C6_    45     1.52597   111.60353   -72.55802
   40    39 S   HC   _H18    46     1.09169   115.48151    27.07286
   41    33 S   SY   _S15    51     1.85045   110.12600    46.97719
   42    41 S   OY   _O9_    52     1.44987   109.92709    54.54747
   43    41 S   OY   _O10    53     1.45036   109.46236   -80.14922
   44    37 S   CM   _C4_    39     1.34279   127.14197    64.93946
   45    44 S   HC   _H16    40     1.08268   121.97500   178.95470
   46    39 S   CMA  _C7_    47     1.35764   129.02193  -152.49276
   47    46 S   OM   _O7_    48     1.26445   127.90449     0.17359
   48    41 S   OS   _O13    54     1.63324    98.87774   166.94513
   49    48 S   HO   _H21    55     0.98600   115.57887   173.89851
   50    44 S   C    _C8_    41     1.47879   119.80147     0.04423
   51    50 S   O    _O8_    42     1.22191   125.25687    59.95869
   52    46 S   OH   _O33    49     1.41001   110.91581   179.96044
   53    52 S   HO   _H19    50     0.97291   105.26027  -180.00000
   54    50 S   OH   _O34    43     1.35567   111.09168  -119.97877
   55    54 S   HO   _H20    44     0.98181   116.74107   179.92087
  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  11   5   4   3
  15   2   1   1  13   5  10   4   6   3   2   5   3   3   2   1
   1   3   2   1   1   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    39    41    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    39    40    46    41    42    43    48  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    44    45    50    39    40    46    47    52    41    42    43    48    49  
   35    36  
   36  
    0  
   38    44    45    50    51    54    39    40    46    41    42    43    48  
   44    45    50    39    41  
   40    46    47    52    53    41    42    43    48    44  
   46    47    52    41  
   42    43    48    49    44    46  
   43    48    49  
   48    49  
   45    50    51    54    55  
   50    51    54  
   47    52    53  
   52    53  
   49  
    0  
   51    54    55  
   54    55  
   53  
    0  
   55  
    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   0.075200   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   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   38   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   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   0.2500   1.242600   2.0025   1.7750   0.025682759  -1.666211680
   42   2.9600   0.1700  -0.577000   1.6780   1.4800   0.001000000  -0.126889456
   43   2.9600   0.1700  -0.577000   1.6780   1.4800   0.001000000  -0.126889456
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0760   0.460100   2.0020   1.7750   0.023028004  -0.852763146
   47   3.1500   0.2500  -0.373900   1.7825   1.5750   0.001000000  -0.126889456
   48   2.9000   0.1400  -0.588100   1.7660   1.5600   0.021068034  -0.322181743
   49   0.5000   0.0300   0.431800   0.9960   0.8600   0.030040813  -0.651083722
   50   3.7500   0.1050   0.520000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.440000   1.9750   1.7500   0.001000000  -0.126889456
   52   3.0700   0.1700  -0.840200   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.355200   0.9960   0.8600   0.030040813  -0.651083722
   54   3.0000   0.1700  -0.530000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.450000   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    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   317.000  1.510
   33    39   317.000  1.510
   33    41   205.000  1.840
   37    38   340.000  1.080
   37    44   549.000  1.340
   44    45   340.000  1.080
   44    50   410.000  1.444
   50    51   570.000  1.229
   50    54   450.000  1.364
   54    55   553.000  0.945
   39    40   340.000  1.080
   39    46   465.000  1.376
   46    47   745.000  1.250
   46    52   510.000  1.338
   52    53   553.000  0.945
   41    42   735.000  1.471
   41    43   735.000  1.471
   41    48   335.000  1.682
   48    49   553.000  0.945
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  112.20000
   29    33    39    75.00000  112.20000
   29    33    41    75.00000  118.00000
   33    37    38    35.00000  117.00000
   33    37    44    70.00000  124.00000
   33    39    40    35.00000  117.00000
   33    39    46    70.00000  124.00000
   33    41    42   100.00000  108.55000
   33    41    43   100.00000  108.55000
   33    41    48   115.00000   98.20800
   37    44    45    35.00000  120.00000
   37    44    50    70.00000  118.70000
   44    37    38    35.00000  120.00000
   44    50    51    80.00000  125.30000
   44    50    54    90.00000  111.55000
   50    44    45    35.00000  119.70000
   50    54    55    35.00000  113.00000
   54    50    51   100.00000  123.32000
   39    33    37    70.00000  110.12100
   39    46    47    65.00000  137.10300
   39    46    52    80.00000  121.38400
   46    39    40    40.00000  120.50800
   46    52    53    70.00000  107.45700
   52    46    47   115.00000  116.36000
   41    33    37    80.00000  107.68000
   41    33    39    80.00000  107.68000
   41    48    49    65.00000  110.03400
   43    41    42   115.00000  120.17200
   48    41    42   135.00000  106.70400
   48    41    43   135.00000  106.70400
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  -0.62250  1.0 1.0
   24    29    33    37  -0.38450 -1.0 2.0
   24    29    33    37   0.81900  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
   24    29    33    41   0.01700  1.0 1.0
   24    29    33    41  -0.23550 -1.0 2.0
   24    29    33    41   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   0.00000  1.0 1.0
   29    33    37    44   0.42700  1.0 1.0
   29    33    37    44  -0.70350 -1.0 2.0
   29    33    37    44  -0.43150  1.0 3.0
   29    33    39    40   0.00000  1.0 1.0
   29    33    39    46   0.42700  1.0 1.0
   29    33    39    46  -0.70350 -1.0 2.0
   29    33    39    46  -0.43150  1.0 3.0
   29    33    41    42  -0.67400  1.0 1.0
   29    33    41    42   0.68950 -1.0 2.0
   29    33    41    42  -0.11550  1.0 3.0
   29    33    41    43  -0.67400  1.0 1.0
   29    33    41    43   0.68950 -1.0 2.0
   29    33    41    43  -0.11550  1.0 3.0
   29    33    41    48   0.00000  1.0 1.0
   33    37    44    45   7.00000 -1.0 2.0
   33    37    44    50   7.00000 -1.0 2.0
   33    39    46    47   7.00000 -1.0 2.0
   33    39    46    52   7.00000 -1.0 2.0
   33    41    48    49  -0.94450  1.0 1.0
   33    41    48    49  -0.35900 -1.0 2.0
   33    41    48    49   0.06400  1.0 3.0
   37    33    39    40   0.00000  1.0 1.0
   37    33    39    46  -0.28300  1.0 1.0
   37    33    39    46   0.26700 -1.0 2.0
   37    33    39    46  -0.63300  1.0 3.0
   37    33    41    42  -0.67400  1.0 1.0
   37    33    41    42   0.68950 -1.0 2.0
   37    33    41    42  -0.11550  1.0 3.0
   37    33    41    43  -0.67400  1.0 1.0
   37    33    41    43   0.68950 -1.0 2.0
   37    33    41    43  -0.11550  1.0 3.0
   37    33    41    48   0.00000  1.0 1.0
   37    44    50    51   1.00000 -1.0 2.0
   37    44    50    54  -0.01000  1.0 1.0
   37    44    50    54   1.29850 -1.0 2.0
   37    44    50    54  -0.09550  1.0 3.0
   38    37    44    45   7.00000 -1.0 2.0
   38    37    44    50   7.00000 -1.0 2.0
   44    50    54    55   1.22000  1.0 1.0
   44    50    54    55   0.17300 -1.0 2.0
   45    44    50    51   0.00000  1.0 1.0
   45    44    50    54   0.81850 -1.0 2.0
   51    50    54    55   0.92200  1.0 1.0
   51    50    54    55   3.74100 -1.0 2.0
   39    33    37    38   0.00000  1.0 1.0
   39    33    37    44  -0.28300  1.0 1.0
   39    33    37    44   0.26700 -1.0 2.0
   39    33    37    44  -0.63300  1.0 3.0
   39    33    41    42  -0.67400  1.0 1.0
   39    33    41    42   0.68950 -1.0 2.0
   39    33    41    42  -0.11550  1.0 3.0
   39    33    41    43  -0.67400  1.0 1.0
   39    33    41    43   0.68950 -1.0 2.0
   39    33    41    43  -0.11550  1.0 3.0
   39    33    41    48   0.00000  1.0 1.0
   39    46    52    53  -0.66100  1.0 1.0
   39    46    52    53   1.20850 -1.0 2.0
   39    46    52    53  -0.36000  1.0 3.0
   40    39    46    47   7.00000 -1.0 2.0
   40    39    46    52   7.00000 -1.0 2.0
   47    46    52    53   2.00000 -1.0 2.0
   41    33    37    38   0.00000  1.0 1.0
   41    33    37    44   0.09700  1.0 1.0
   41    33    37    44   0.15600 -1.0 2.0
   41    33    37    44  -0.50800  1.0 3.0
   41    33    39    40   0.00000  1.0 1.0
   41    33    39    46   0.09700  1.0 1.0
   41    33    39    46   0.15600 -1.0 2.0
   41    33    39    46  -0.50800  1.0 3.0
   42    41    48    49   0.67600  1.0 1.0
   42    41    48    49   0.52900 -1.0 2.0
   42    41    48    49   0.12800  1.0 3.0
   43    41    48    49   0.67600  1.0 1.0
   43    41    48    49   0.52900 -1.0 2.0
   43    41    48    49   0.12800  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
   33    38    37    44  15.00000 -1.0 2.0
   50    45    44    37  15.00000 -1.0 2.0
   44    54    50    51  10.50000 -1.0 2.0
   33    40    39    46  15.00000 -1.0 2.0
   47    52    46    39  15.00000 -1.0 2.0
END
