* LIGAND DATABASE FILE (OPLS2005)
*
001      61    63    107    174     312
    1     0 S   NP   _N1_     1    28.18773    96.09396   -23.96365
    2     1 S   H    _HN1     2     1.02947    84.61863   -29.70805
    3     1 S   H    _H1_     3     1.02830    24.56664   127.22372
    4     1 S   H    _H2_     4     1.02772   107.19330  -137.26050
    5     1 S   CT   _CA1     5     1.50194   129.66825    82.44660
    6     5 S   HC   _HA1     6     1.09569   105.18321    77.87430
    7     5 S   CO3  _C1_     7     1.53822   111.87181   -42.29847
    8     7 S   O2Z  _O11     8     1.26391   115.01418   -50.94932
    9     7 S   O2Z  _O12     9     1.26181   114.93601   127.44616
   10     5 S   CT   _CB1    10     1.53047   107.32672  -164.23311
   11    10 S   HC   HB11    11     1.09844   109.58526   -47.72622
   12    10 S   HC   HB12    12     1.09803   110.40797    68.84725
   13    10 S   CT   _CG1    13     1.53064   112.63079  -168.52259
   14    13 S   HC   HG11    14     1.09578   110.78269   -63.14780
   15    13 S   HC   HG12    15     1.09648   109.75745    56.09648
   16    13 S   C    _CD1    16     1.51864   111.68896   176.83071
   17    16 S   O    _OE1    17     1.22833   123.07902    14.17433
   18    16 S   N    _N2_    18     1.38406   112.19582  -166.59822
   19    18 S   H    _HN2    19     1.01919   119.36718     2.26494
   20    18 S   CT1  _CA2    20     1.45861   122.69298  -179.81655
   21    20 S   HC   _HA2    21     1.09732   108.53137    32.70244
   22    20 S   C    _C2_    22     1.52962   107.32819   -84.66113
   23    22 S   O    _O2_    23     1.22983   123.13020   -28.78307
   24    20 S   CT   _CB2    32     1.53076   112.11452   155.66676
   25    24 S   HC   HB21    33     1.09619   109.82484    58.12587
   26    24 S   HC   HB22    34     1.09530   110.67097   176.01434
   27    22 S   N    _N3_    24     1.38541   112.58415   153.72015
   28    27 S   H    _HN3    25     1.01651   120.36555    -1.32854
   29    24 S   S    _SG2    35     1.82902   111.13091   -64.03820
   30    27 S   CT   _CA3    26     1.45353   122.37379   178.86530
   31    30 S   HC   HA31    27     1.09568   107.56063   -61.18230
   32    30 S   HC   HA32    28     1.09570   107.82537    55.10501
   33    29 S   CA   _C11    36     1.79799    98.78315   148.75494
   34    30 S   CO3  _C3_    29     1.52873   114.45407   177.04276
   35    34 S   O2Z  _O31    30     1.26321   116.12022    -1.12361
   36    34 S   O2Z  _O32    31     1.26458   114.38996   178.92298
   37    33 S   CA   _C10    37     1.41724   121.01563   -87.92540
   38    33 S   CA   _C12    55     1.40049   120.81688    92.85836
   39    37 S   CA   _C9_    38     1.42519   120.15575   179.90309
   40    38 S   CO3  _C16    56     1.49780   121.67005    -0.35498
   41    40 S   O2Z  _O38    57     1.26916   116.45192   -85.64025
   42    40 S   O2Z  _O37    58     1.26904   116.43229    94.98921
   43    37 S   CO3  _C17    59     1.49718   119.29577    -0.52749
   44    43 S   O2Z  _O40    60     1.26919   116.58457    85.94025
   45    43 S   O2Z  _O39    61     1.26802   116.33842   -94.79400
   46    39 S   C5A  _C6_    39     1.43107   125.28873  -179.06770
   47    46 S   C5BC _C5_    40     1.39127   121.90662   179.92087
   48    47 S   C5BC _C4_    41     1.41735   108.87489  -179.77100
   49    48 S   HA   _H3_    42     1.08209   126.96384   179.92087
   50    47 S   CO4  _C15    49     1.44043   122.61129     0.13988
   51    50 S   O    _O36    50     1.22306   124.17214   179.80021
   52    48 S   C5A  _C7_    43     1.37440   106.87863     0.09065
   53    50 S   CO4  _C14    51     1.50481   117.11048    -0.26834
   54    53 S   O    _O35    52     1.22060   119.04079  -179.82983
   55    46 S   NA   _N4_    44     1.38175   132.56850     0.13988
   56    55 S   H    _H4_    45     1.01083   125.65305    -0.40105
   57    52 S   CO3  _C8_    46     1.48107   126.98087   179.75451
   58    57 S   O2Z  _O34    47     1.26806   116.23150  -179.29003
   59    57 S   O2Z  _O33    48     1.26845   116.91962     0.64650
   60    39 S   CA   _C13    53     1.40721   115.76076     0.70053
   61    60 S   NB   _N5_    54     1.35202   125.08708    -0.13122
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   7   5   4   3
  12   2   1   1  12   8  14   4   2   1   4   1   1  12  11  10
   4   7   3   5   3   2   5   1   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    38    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    39    61    38    40    43  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    39    46    60    61    38    40    41    42    43    44    45  
   35    36  
   36  
    0  
   39    46    47    55    53    60    61    38    40    43    44    45  
   40    41    42    43    39    53    60    61  
   46    47    48    52    55    56    50    53    54    60    61    43    44    45  
   41    42    60    61  
   42    61  
   61  
   44    45    46    60  
   45  
    0  
   47    48    49    52    55    56    57    50    51    53    60    61  
   48    49    52    55    56    57    50    51    53    54    60  
   49    52    55    56    57    58    59    50    51    53  
   52    55    57    50  
   51    53    54    60    61    52    55  
   53    54    60  
   55    56    57    58    59  
   54    60    61  
   60    61  
   56    57    58    59    60  
   57  
   58    59  
   59  
    0  
   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  -0.320000   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   3.5500   0.0700  -0.139500   2.5000   1.7750   0.001000000  -0.843144165
   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   0.0700   0.177000   2.5000   1.7750   0.001000000  -0.843144165
   38   3.5500   0.0700   0.370000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0700  -0.292000   2.5000   1.7750   0.001000000  -0.843144165
   40   3.7500   0.1050   0.715000   2.1120   1.8750   0.001000000  -0.126889456
   41   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   43   3.7500   0.1050   0.715000   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   3.5500   0.0700  -0.008000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700  -0.146000   2.5000   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.149000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.118000   1.3810   1.2100   0.030040813   0.268726247
   50   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   51   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   52   3.5500   0.0700  -0.123000   2.5000   1.7750   0.001000000  -0.843144165
   53   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   56   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   57   3.7500   0.1050   0.715000   2.1120   1.8750   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   59   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   60   3.5500   0.0700   0.370000   2.5000   1.7750   0.001000000  -0.843144165
   61   3.2500   0.1700  -0.678000   1.8650   1.6500   0.001000000  -0.511443539
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   250.000  1.760
   33    37   469.000  1.400
   33    38   469.000  1.400
   37    39   469.000  1.400
   37    43   400.000  1.490
   39    46   365.000  1.450
   39    60   469.000  1.400
   46    47   546.000  1.367
   46    55   427.000  1.381
   47    48   469.000  1.424
   47    50   320.000  1.468
   48    49   367.000  1.080
   48    52   546.000  1.367
   52    55   427.000  1.381
   52    57   325.000  1.466
   55    56   434.000  1.010
   57    58   656.000  1.250
   57    59   656.000  1.250
   50    51   570.000  1.229
   50    53   250.000  1.523
   53    54   570.000  1.229
   53    60   310.000  1.470
   60    61   483.000  1.339
   61    38   483.000  1.339
   38    40   400.000  1.490
   40    41   656.000  1.250
   40    42   656.000  1.250
   43    44   656.000  1.250
   43    45   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    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  104.20000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    85.00000  119.40000
   29    33    38    85.00000  119.40000
   33    37    39    63.00000  120.00000
   33    37    43    85.00000  120.00000
   33    38    61    70.00000  124.00000
   33    38    40    85.00000  120.00000
   37    39    46    65.00000  121.65900
   37    39    60    63.00000  120.00000
   37    43    44    80.00000  120.40000
   37    43    45    80.00000  120.40000
   39    46    47    55.00000  132.24500
   39    46    55    75.00000  120.22300
   39    60    53    60.00000  119.52600
   39    60    61    70.00000  124.00000
   46    47    48    70.00000  107.30000
   46    47    50    60.00000  121.69000
   46    55    52    70.00000  109.80000
   46    55    56    35.00000  120.00000
   47    48    49    35.00000  127.50000
   47    48    52    70.00000  107.30000
   47    50    51    80.00000  122.10000
   47    50    53    60.00000  117.28700
   48    52    55    70.00000  107.70000
   48    52    57    55.00000  130.80000
   52    48    49    35.00000  125.70000
   52    55    56    35.00000  120.00000
   52    57    58    80.00000  120.87000
   52    57    59    80.00000  120.87000
   55    46    47    70.00000  107.70000
   57    52    55    70.00000  119.02500
   59    57    58    80.00000  126.00000
   50    47    48    50.00000  131.05000
   50    53    54    80.00000  119.30300
   50    53    60    60.00000  117.28700
   53    50    51    80.00000  119.30300
   53    60    61    75.00000  117.56100
   60    39    46    65.00000  121.65900
   60    53    54    75.00000  123.78400
   60    61    38    70.00000  117.00000
   61    38    40    75.00000  117.56100
   38    33    37    63.00000  120.00000
   38    40    41    80.00000  120.40000
   38    40    42    80.00000  120.40000
   42    40    41    80.00000  126.00000
   43    37    39    85.00000  120.00000
   45    43    44    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  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  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   0.63250 -1.0 2.0
   24    29    33    38   0.63250 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    39   3.62500 -1.0 2.0
   29    33    37    43   3.62500 -1.0 2.0
   29    33    38    61   3.62500 -1.0 2.0
   29    33    38    40   3.62500 -1.0 2.0
   33    37    39    46   3.62500 -1.0 2.0
   33    37    39    60   3.62500 -1.0 2.0
   33    37    43    44   1.05000 -1.0 2.0
   33    37    43    45   1.05000 -1.0 2.0
   33    38    40    41   1.05000 -1.0 2.0
   33    38    40    42   1.05000 -1.0 2.0
   37    33    38    61   3.62500 -1.0 2.0
   37    33    38    40   3.62500 -1.0 2.0
   37    39    46    47  -0.19450  1.0 1.0
   37    39    46    47   0.63300 -1.0 2.0
   37    39    46    47   0.07450  1.0 3.0
   37    39    46    55  -0.20000  1.0 1.0
   37    39    46    55   0.58050 -1.0 2.0
   37    39    60    53   3.62500 -1.0 2.0
   37    39   -60    61   3.62500 -1.0 2.0
   39    37    43    44   1.05000 -1.0 2.0
   39    37    43    45   1.05000 -1.0 2.0
   39    46    47    48   3.62500 -1.0 2.0
   39    46    47    50   3.62500 -1.0 2.0
   39    46    55    52   3.62500 -1.0 2.0
   39    46    55    56   2.00000 -1.0 2.0
   39    60    61    38   3.62500 -1.0 2.0
   46    39    60    53   3.62500 -1.0 2.0
   46    39    60    61   3.62500 -1.0 2.0
   46    47    48    49   3.62500 -1.0 2.0
   46    47   -48    52   3.62500 -1.0 2.0
   46    47    50    51   1.05000 -1.0 2.0
   46    47   -50    53   0.56600 -1.0 2.0
   47    46   -55    52   3.62500 -1.0 2.0
   47    46    55    56   2.00000 -1.0 2.0
   47    48   -52    55   3.62500 -1.0 2.0
   47    48    52    57   3.62500 -1.0 2.0
   47    50    53    54   0.03000  1.0 1.0
   47    50    53    54   0.58800 -1.0 2.0
   47    50    53    54   0.15550  1.0 3.0
   47    50    53    60   0.43900  1.0 1.0
   47    50    53    60  -0.18150 -1.0 2.0
   47    50    53    60  -0.03650  1.0 3.0
   48    47    50    51   1.05000 -1.0 2.0
   48    47    50    53   0.56600 -1.0 2.0
   48    52   -55    46   3.62500 -1.0 2.0
   48    52    55    56   2.00000 -1.0 2.0
   48    52    57    58   1.05000 -1.0 2.0
   48    52    57    59   1.05000 -1.0 2.0
   49    48    52    55   3.62500 -1.0 2.0
   49    48    52    57   3.62500 -1.0 2.0
   55    46   -47    48   3.62500 -1.0 2.0
   55    46    47    50   3.62500 -1.0 2.0
   55    52    57    58   1.85000 -1.0 2.0
   55    52    57    59   1.85000 -1.0 2.0
   57    52    55    46   3.62500 -1.0 2.0
   57    52    55    56   2.00000 -1.0 2.0
   50    47    48    49   3.62500 -1.0 2.0
   50    47    48    52   3.62500 -1.0 2.0
   50    53   -60    39   0.56600 -1.0 2.0
   50    53    60    61   0.56600 -1.0 2.0
   51    50    53    54   0.06100 -1.0 2.0
   51    50    53    60   0.03000  1.0 1.0
   51    50    53    60   0.58800 -1.0 2.0
   51    50    53    60   0.15550  1.0 3.0
   53    60    61    38   3.62500 -1.0 2.0
   54    53    60    39   1.05000 -1.0 2.0
   54    53    60    61   1.05000 -1.0 2.0
   60    39   -46    47  -0.19450  1.0 1.0
   60    39   -46    47   0.63300 -1.0 2.0
   60    39   -46    47   0.07450  1.0 3.0
   60    39    46    55  -0.20000  1.0 1.0
   60    39    46    55   0.58050 -1.0 2.0
   60    61   -38    33   3.62500 -1.0 2.0
   60    61    38    40   3.62500 -1.0 2.0
   61    38    40    41   1.05000 -1.0 2.0
   61    38    40    42   1.05000 -1.0 2.0
   38    33   -37    39   3.62500 -1.0 2.0
   38    33    37    43   3.62500 -1.0 2.0
   43    37    39    46   3.62500 -1.0 2.0
   43    37    39    60   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
   35    30    34    36  10.50000 -1.0 2.0
   37    38    33    29   4.00000 -1.0 2.0
   39    43    37    33   4.00000 -1.0 2.0
   46    60    39    37   4.00000 -1.0 2.0
   47    55    46    39   4.00000 -1.0 2.0
   48    50    47    46   4.00000 -1.0 2.0
   52    49    48    47   1.10000 -1.0 2.0
   57    55    52    48   4.00000 -1.0 2.0
   56    46    55    52   1.00000 -1.0 2.0
   58    52    57    59  10.50000 -1.0 2.0
   47    53    50    51  10.50000 -1.0 2.0
   50    60    53    54  10.50000 -1.0 2.0
   53    61    60    39   4.00000 -1.0 2.0
   61    40    38    33   4.00000 -1.0 2.0
   41    38    40    42  10.50000 -1.0 2.0
   44    37    43    45  10.50000 -1.0 2.0
END
