* LIGAND DATABASE FILE (OPLS2005)
*
001      61    62    108    162     311
    1     0 S   NP   _N1_     1    29.96804    90.99188   -15.86850
    2     1 S   H    _HN1     2     1.03262    94.80106   -29.62376
    3     1 S   H    _H1_     3     1.02902   139.52546    94.88304
    4     1 S   H    _H2_     4     1.02795    32.82248    84.60213
    5     1 S   CT   _CA1     5     1.50001    89.36317  -142.67333
    6     5 S   HC   _HA1     6     1.09570   105.26471    35.54559
    7     5 S   CO3  _C1_     7     1.53791   112.33902   -84.74467
    8     7 S   O2Z  _O11     8     1.26367   115.11395   -48.59516
    9     7 S   O2Z  _O12     9     1.26258   114.92367   130.63071
   10     5 S   CT   _CB1    10     1.53039   107.69847   153.56772
   11    10 S   HC   HB11    11     1.09532   109.17310   -51.85230
   12    10 S   HC   HB12    12     1.09792   110.53530    64.48301
   13    10 S   CT   _CG1    13     1.53013   112.86780  -172.38640
   14    13 S   HC   HG11    14     1.09569   111.20797   -65.33140
   15    13 S   HC   HG12    15     1.09608   110.59279    53.85304
   16    13 S   C    _CD1    16     1.51472   110.49111   173.47520
   17    16 S   O    _OE1    17     1.22829   121.82890  -100.13267
   18    16 S   N    _N2_    18     1.38312   113.03148    79.13602
   19    18 S   H    _HN2    19     1.01558   119.15447     4.62228
   20    18 S   CT1  _CA2    20     1.45862   122.79974  -176.54436
   21    20 S   HC   _HA2    21     1.09562   108.36930    36.62198
   22    20 S   C    _C2_    22     1.52951   107.82169   -80.76553
   23    22 S   O    _O2_    23     1.22943   123.12165   -28.35511
   24    20 S   CT   _CB2    32     1.53180   112.11694   159.85690
   25    24 S   HC   HB21    33     1.09690   109.49822    58.69942
   26    24 S   HC   HB22    34     1.09547   111.60278   175.91966
   27    22 S   N    _N3_    24     1.38514   112.39324   154.53388
   28    27 S   H    _HN3    25     1.01641   120.36979    -2.46204
   29    24 S   S    _SG2    35     1.82479   113.32936   -59.97309
   30    27 S   CT   _CA3    26     1.45344   122.55069   178.58611
   31    30 S   HC   HA31    27     1.09563   107.83697   -55.58460
   32    30 S   HC   HA32    28     1.09559   107.61123    60.78801
   33    29 S   CT   _C13    36     1.83502   100.82294   -83.64164
   34    33 S   HC   _H10    37     1.09525   106.51921  -121.42342
   35    33 S   HC   _H11    38     1.09488   109.53103    -5.24232
   36    30 S   CO3  _C3_    29     1.52907   114.22498  -177.48596
   37    36 S   O2Z  _O31    30     1.26354   116.02565     0.04846
   38    36 S   O2Z  _O32    31     1.26426   114.43259  -180.00000
   39    33 S   CT   _C11    39     1.53747   112.92566   117.80459
   40    39 S   HC   _H3_    40     1.09935   106.71001   171.70687
   41    39 S   C    _C12    41     1.53131   111.40242    58.25231
   42    41 S   O    _O35    42     1.23036   122.49047    40.73355
   43    39 S   OS   _O34    53     1.41567   107.78765   -75.64557
   44    41 S   N    _N4_    43     1.37054   114.79462  -142.08942
   45    44 S   H    _H9_    44     1.01703   118.49301  -176.00541
   46    44 S   CA   _C8_    45     1.39975   122.95382     2.37817
   47    46 S   CA   _C7_    46     1.40587   120.73828  -178.77475
   48    47 S   CA   _C6_    47     1.40620   118.71594   179.69868
   49    48 S   HA   _H7_    48     1.08917   119.64050  -179.64946
   50    47 S   CO3  _C14    59     1.50223   122.48024    -3.09870
   51    50 S   O2Z  _O37    60     1.27103   116.29350  -136.49816
   52    50 S   O2Z  _O36    61     1.26887   117.38459    42.09712
   53    48 S   CA   _C5_    49     1.39829   121.36181     0.92175
   54    53 S   CA   _C10    50     1.39352   119.10799     0.63118
   55    54 S   HA   _H8_    51     1.08614   121.50040   178.19496
   56    53 S   OS   _O33    54     1.36921   114.96740   179.75691
   57    46 S   CA   _C9_    52     1.39415   119.28269     3.18174
   58    56 S   CT   _C4_    55     1.42276   116.79803  -179.32247
   59    58 S   HC   _H4_    56     1.09428   107.73734  -179.54286
   60    58 S   HC   _H5_    57     1.09473   111.15094    62.73189
   61    58 S   HC   _H6_    58     1.09501   111.16371   -61.79563
  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   7   5   4   3
   9   5   4   2   1   1   9   5   7   4   7   7   3  10   9  10
   4   4   1   1   8   4   2   5   1   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    41    43  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    44    57    43  
   35    39    40    41    43  
   39    40    41    43  
   37    38  
   38  
    0  
   40    41    42    44    45    46    54    57    43  
   41    42    44    57    43  
   42    44    45    46    47    57    43  
   44    45    46    43  
   44    46    47    53    54    55    57  
   45    46    47    48    54    57    50  
   46    47    57  
   47    48    49    53    54    55    57    50    51    52  
   48    49    53    54    57    56    50    51    52  
   49    53    54    55    57    56    58    50    51    52  
   53    54    56    50  
   51    52    53    57  
   52  
    0  
   54    55    57    56    58    59    60    61  
   55    57    56    58  
   57    56  
   58    59    60    61    57  
    0  
   59    60    61  
   60    61  
   61  
    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   0.047500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660   0.170000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   43   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   44   3.2500   0.1700  -0.385000   1.8100   1.6000   0.054801302  -1.445846770
   45   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   46   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.7500   0.1050   0.715000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   53   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   2.9000   0.1400  -0.285000   1.7660   1.5600   0.020110767  -0.896042159
   57   3.5500   0.0700   0.085000   2.5000   1.7750   0.001000000  -0.843144165
   58   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   60   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.030000   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   340.000  1.090
   33    35   340.000  1.090
   33    39   268.000  1.529
   39    40   340.000  1.090
   39    41   317.000  1.522
   39    43   320.000  1.410
   41    42   570.000  1.229
   41    44   490.000  1.335
   44    45   434.000  1.010
   44    46   360.000  1.404
   46    47   469.000  1.400
   46    57   469.000  1.400
   47    48   469.000  1.400
   47    50   400.000  1.490
   48    49   367.000  1.080
   48    53   469.000  1.400
   53    54   469.000  1.400
   53    56   450.000  1.364
   54    55   367.000  1.080
   54    57   469.000  1.400
   57    43   450.000  1.364
   56    58   320.000  1.410
   58    59   340.000  1.090
   58    60   340.000  1.090
   58    61   340.000  1.090
   50    51   656.000  1.250
   50    52   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    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    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    37.50000  110.70000
   33    39    41    63.00000  111.10000
   33    39    43    50.00000  109.50000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    41    42    80.00000  120.40000
   39    41    44    70.00000  116.60000
   39    43    57    75.00000  111.00000
   41    39    40    35.00000  109.50000
   41    44    45    35.00000  119.80000
   41    44    46    65.00000  121.96500
   44    41    42    80.00000  122.90000
   44    46    47    70.00000  119.01900
   44    46    57    70.00000  119.01900
   46    44    45    45.00000  118.23600
   46    47    48    63.00000  120.00000
   46    47    50    85.00000  120.00000
   46    57    54    63.00000  120.00000
   46    57    43    70.00000  120.00000
   47    48    49    35.00000  120.00000
   47    48    53    63.00000  120.00000
   47    50    51    80.00000  120.40000
   47    50    52    80.00000  120.40000
   48    53    54    63.00000  120.00000
   48    53    56    70.00000  120.00000
   53    48    49    35.00000  120.00000
   53    54    55    35.00000  120.00000
   53    54    57    63.00000  120.00000
   53    56    58    75.00000  111.00000
   54    57    43    70.00000  120.00000
   57    46    47    63.00000  120.00000
   57    54    55    35.00000  120.00000
   43    39    40    35.00000  109.50000
   43    39    41    90.00000  108.55600
   56    53    54    70.00000  120.00000
   56    58    59    35.00000  109.50000
   56    58    60    35.00000  109.50000
   56    58    61    35.00000  109.50000
   60    58    59    33.00000  107.80000
   61    58    59    33.00000  107.80000
   61    58    60    33.00000  107.80000
   50    47    48    85.00000  120.00000
   52    50    51    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    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   0.32350  1.0 3.0
   24    29    33    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.56750  1.0 1.0
   29    33    39    41  -0.07550 -1.0 2.0
   29    33    39    41   0.20000  1.0 3.0
   29    33    39    43   0.56750  1.0 1.0
   29    33    39    43  -0.07550 -1.0 2.0
   29    33    39    43   0.20000  1.0 3.0
   33    39    41    42   0.30150 -1.0 2.0
   33    39    41    44   1.39750  1.0 1.0
   33    39    41    44  -0.07950 -1.0 2.0
   33    39    41    44  -0.18750  1.0 3.0
   33    39    43    57  -0.32850  1.0 1.0
   33    39    43    57  -0.35800 -1.0 2.0
   33    39    43    57   0.33950  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41  -0.11250  1.0 3.0
   34    33    39    43   0.23400  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    41  -0.11250  1.0 3.0
   35    33    39    43   0.23400  1.0 3.0
   39    41    44    45   2.45000 -1.0 2.0
   39    41    44    46   0.76000  1.0 1.0
   39    41    44    46   4.11600 -1.0 2.0
   40    39    41    42   0.00000  1.0 1.0
   40    39    41    44   0.00000  1.0 1.0
   40    39    43    57   0.08050  1.0 3.0
   41    39    43    57  -0.25600  1.0 1.0
   41    39    43    57  -0.40050 -1.0 2.0
   41    39    43    57   0.34700  1.0 3.0
   41    44    46    47   1.00100  1.0 1.0
   41    44    46    47   0.85050 -1.0 2.0
   41    44   -46    57   1.00100  1.0 1.0
   41    44   -46    57   0.85050 -1.0 2.0
   42    41    44    45   2.45000 -1.0 2.0
   42    41    44    46   0.04000 -1.0 2.0
   44    46    47    48   3.62500 -1.0 2.0
   44    46    47    50   3.62500 -1.0 2.0
   44    46    57    54   3.62500 -1.0 2.0
   44    46    57    43   3.62500 -1.0 2.0
   45    44    46    47   0.97800 -1.0 2.0
   45    44    46    57   0.97800 -1.0 2.0
   46    47    48    49   3.62500 -1.0 2.0
   46    47    48    53   3.62500 -1.0 2.0
   46    47    50    51   1.05000 -1.0 2.0
   46    47    50    52   1.05000 -1.0 2.0
   46    57   -43    39   1.63200 -1.0 2.0
   47    46    57    54   3.62500 -1.0 2.0
   47    46    57    43   3.62500 -1.0 2.0
   47    48   -53    54   3.62500 -1.0 2.0
   47    48    53    56   3.62500 -1.0 2.0
   48    47    50    51   1.05000 -1.0 2.0
   48    47    50    52   1.05000 -1.0 2.0
   48    53    54    55   3.62500 -1.0 2.0
   48    53    54    57   3.62500 -1.0 2.0
   48    53    56    58   1.63200 -1.0 2.0
   49    48    53    54   3.62500 -1.0 2.0
   49    48    53    56   3.62500 -1.0 2.0
   53    54   -57    46   3.62500 -1.0 2.0
   53    54    57    43   3.62500 -1.0 2.0
   53    56    58    59   0.08050  1.0 3.0
   53    56    58    60   0.08050  1.0 3.0
   53    56    58    61   0.08050  1.0 3.0
   54    53    56    58   1.63200 -1.0 2.0
   54    57    43    39   1.63200 -1.0 2.0
   55    54    57    46   3.62500 -1.0 2.0
   55    54    57    43   3.62500 -1.0 2.0
   57    46   -47    48   3.62500 -1.0 2.0
   57    46    47    50   3.62500 -1.0 2.0
   43    39    41    42   0.30150 -1.0 2.0
   43    39   -41    44   0.00000  1.0 1.0
   56    53    54    55   3.62500 -1.0 2.0
   56    53    54    57   3.62500 -1.0 2.0
   50    47    48    49   3.62500 -1.0 2.0
   50    47    48    53   3.62500 -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
   39    44    41    42  10.50000 -1.0 2.0
   45    41    44    46   1.00000 -1.0 2.0
   47    57    46    44   4.00000 -1.0 2.0
   48    50    47    46   4.00000 -1.0 2.0
   53    49    48    47   1.10000 -1.0 2.0
   54    56    53    48   4.00000 -1.0 2.0
   57    55    54    53   1.10000 -1.0 2.0
   54    43    57    46   4.00000 -1.0 2.0
   51    47    50    52  10.50000 -1.0 2.0
END
