* LIGAND DATABASE FILE (OPLS2005)
*
001      61    60    105    153     311
    1     0 S   NP   _N1_     1    30.77623    99.04863   -22.22765
    2     1 S   H    _HN1     2     1.03469   143.24907  -110.55055
    3     1 S   H    _H1_     3     1.02827    46.66183   -53.71519
    4     1 S   H    _H2_     4     1.02769    67.58134   159.91775
    5     1 S   CT   _CA1     5     1.50044   103.24461    52.66388
    6     5 S   HC   _HA1     6     1.09387   104.79935   128.61489
    7     5 S   CO3  _C1_     7     1.53728   113.54374     7.96703
    8     7 S   O2Z  _O11     8     1.26404   115.14166   -25.72939
    9     7 S   O2Z  _O12     9     1.26314   115.12654   154.03676
   10     5 S   CT   _CB1    10     1.53007   107.60102  -113.08291
   11    10 S   HC   HB11    11     1.09541   109.51176   -38.77549
   12    10 S   HC   HB12    12     1.09834   110.33079    76.85938
   13    10 S   CT   _CG1    13     1.53266   112.88609  -161.43353
   14    13 S   HC   HG11    14     1.09552   110.84767   -96.87032
   15    13 S   HC   HG12    15     1.09629   111.73119    22.41214
   16    13 S   C    _CD1    16     1.51458   109.67539   142.91736
   17    16 S   O    _OE1    17     1.22766   121.96421    91.74935
   18    16 S   N    _N2_    18     1.38551   112.34190   -85.54171
   19    18 S   H    _HN2    19     1.01638   118.94727    -3.12725
   20    18 S   CT1  _CA2    20     1.46095   123.69147   175.38735
   21    20 S   HC   _HA2    21     1.09716   109.13174   -13.69036
   22    20 S   C    _C2_    22     1.53764   108.51544  -129.31404
   23    22 S   O    _O2_    23     1.23055   122.21918  -154.18895
   24    20 S   CT   _CB2    32     1.53454   111.91175   108.71781
   25    24 S   HC   HB21    33     1.09472   110.19819    58.80480
   26    24 S   HC   HB22    34     1.09556   110.04307   176.07310
   27    22 S   N    _N3_    24     1.38372   113.82959    32.80223
   28    27 S   H    _HN3    25     1.01465   119.10054    -2.03711
   29    24 S   S    _SG2    35     1.82982   112.30056   -65.65706
   30    27 S   CT   _CA3    26     1.45324   123.43307   178.26291
   31    30 S   HC   HA31    27     1.09551   107.17115   -70.85125
   32    30 S   HC   HA32    28     1.09552   108.29148    45.53474
   33    29 S   CT   _C8_    36     1.85548   101.01177   124.76695
   34    30 S   CO3  _C3_    29     1.53046   114.29482   167.56519
   35    34 S   O2Z  _O31    30     1.26441   116.27242    -9.14325
   36    34 S   O2Z  _O32    31     1.26410   114.45279   171.00385
   37    33 S   CO3  _C9_    37     1.55553   100.41017   166.73356
   38    37 S   O2Z  _O40    38     1.26754   115.13813   -89.69950
   39    37 S   O2Z  _O39    39     1.26585   115.99546    90.48684
   40    33 S   CT   _C4_    40     1.53893   110.13203   -70.69826
   41    40 S   HC   _H3_    41     1.09624   109.24361    58.84217
   42    40 S   HC   _H4_    42     1.09918   108.23486   -56.91279
   43    33 S   OH   _O41    60     1.42525   109.92454    52.07843
   44    43 S   HO   _H12    61     0.97423   106.32418    66.56960
   45    40 S   CT   _C5_    43     1.55951   118.00654  -179.36975
   46    45 S   CT   _C6_    44     1.54087   111.76238   -67.90407
   47    46 S   HC   _H5_    45     1.09288   111.21390    71.73696
   48    46 S   HC   _H6_    46     1.09489   111.23872   -50.45511
   49    45 S   CT   _C7_    49     1.54463   109.26727   168.97623
   50    49 S   HC   _H8_    50     1.09662   110.14038   -59.43229
   51    49 S   HC   _H9_    51     1.09591   110.93978  -176.36773
   52    45 S   OH   _O38    58     1.43012   110.49683    51.59593
   53    52 S   HO   _H11    59     0.97444   108.09552    44.55993
   54    46 S   OH   _O33    47     1.42656   110.88630  -170.63064
   55    54 S   HO   _H7_    48     0.97191   107.03424   176.74352
   56    49 S   OS   _O34    52     1.42146   110.67453    60.26674
   57    56 S   P2   _P1_    53     1.63104   119.45492   153.84925
   58    57 S   O2Z  _O37    54     1.51155   109.88954   -54.36048
   59    57 S   O2Z  _O35    55     1.51208   108.29454   172.17246
   60    57 S   OS   _O36    56     1.62956    99.55554    59.57352
   61    60 S   HO   _H10    57     0.98447   116.78471    82.05819
  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  10   5   4   3
  12   2   1   1   8   3   2  15   6   5   2   1  12  10   5   4
  10   4   3   3   1   1   1   5   4   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    40    43    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    39    40    41    42    45    43    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    40    41    42    45    46    49    52    43    44  
   35    36  
   36  
    0  
   38    39    40    41    42    45    43    44  
   39    40    43  
   40    43  
   41    42    45    46    47    48    54    49    50    51    56    52    53    43    44  
   42    45    46    49    52    43  
   45    46    49    52    43  
   44    45  
    0  
   46    47    48    54    55    49    50    51    56    57    52    53  
   47    48    54    55    49    50    51    56    52    53  
   48    54    55    49    52  
   54    55    49    52  
   50    51    56    57    58    59    60    52    53    54  
   51    56    57    52  
   56    57    52  
   53    54    56  
    0  
   55  
    0  
   57    58    59    60    61  
   58    59    60    61  
   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   0.332500   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   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   40   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   43   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   44   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   45   3.5000   0.0660   0.265000   1.9750   1.7500   0.005000000  -0.741685710
   46   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   53   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   54   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   55   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   56   2.8500   0.1400  -0.610000   1.5900   1.4000   0.020110767  -0.896042159
   57   3.7400   0.2000   1.662500   2.1070   1.8700   0.005000000   0.000000000
   58   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   59   2.9800   0.2000  -0.970000   1.6890   1.4900   0.001000000  -0.126889456
   60   2.8500   0.1400  -0.692500   1.7660   1.5600   0.021068034  -0.322181743
   61   0.5000   0.0300   0.380000   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  1.522
   33    40   268.000  1.529
   33    43   320.000  1.410
   37    38   656.000  1.250
   37    39   656.000  1.250
   40    41   340.000  1.090
   40    42   340.000  1.090
   40    45   268.000  1.529
   45    46   268.000  1.529
   45    49   268.000  1.529
   45    52   320.000  1.410
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    54   320.000  1.410
   54    55   553.000  0.945
   49    50   340.000  1.090
   49    51   340.000  1.090
   49    56   320.000  1.410
   56    57   230.000  1.697
   57    58   525.000  1.480
   57    59   525.000  1.480
   57    60   230.000  1.697
   60    61   553.000  0.945
   52    53   553.000  0.945
   43    44   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    70.00000  116.78000
   29    33    40    75.00000  111.63000
   29    33    43    85.00000  114.68000
   33    37    38    70.00000  117.00000
   33    37    39    70.00000  117.00000
   33    40    41    37.50000  110.70000
   33    40    42    37.50000  110.70000
   33    40    45    58.35000  112.70000
   33    43    44    55.00000  108.50000
   39    37    38    80.00000  126.00000
   40    33    37    70.00000  109.69300
   40    45    46    58.35000  112.70000
   40    45    49    58.35000  112.70000
   40    45    52    50.00000  109.50000
   42    40    41    33.00000  107.80000
   45    40    41    37.50000  110.70000
   45    40    42    37.50000  110.70000
   45    46    47    37.50000  110.70000
   45    46    48    37.50000  110.70000
   45    46    54    50.00000  109.50000
   45    49    50    37.50000  110.70000
   45    49    51    37.50000  110.70000
   45    49    56    50.00000  109.50000
   45    52    53    55.00000  108.50000
   46    54    55    55.00000  108.50000
   48    46    47    33.00000  107.80000
   54    46    47    35.00000  109.50000
   54    46    48    35.00000  109.50000
   49    45    46    58.35000  112.70000
   49    56    57   100.00000  120.50000
   51    49    50    33.00000  107.80000
   56    49    50    35.00000  109.50000
   56    49    51    35.00000  109.50000
   56    57    58   100.00000  108.23000
   56    57    59   100.00000  108.23000
   56    57    60    45.00000  102.60000
   57    60    61    45.00000  108.50000
   59    57    58   140.00000  119.90000
   60    57    58   100.00000  108.23000
   60    57    59   100.00000  108.23000
   52    45    46    50.00000  109.50000
   52    45    49    50.00000  109.50000
   43    33    37    95.00000  109.52300
   43    33    40    50.00000  109.50000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    34    35   0.00000  1.0 1.0
   27    30    34    36   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    37   0.01700  1.0 1.0
   24    29    33    37  -0.23550 -1.0 2.0
   24    29    33    37   0.21350  1.0 3.0
   24    29    33    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   0.21350  1.0 3.0
   24    29    33    43   0.13850  1.0 1.0
   24    29    33    43  -1.34450 -1.0 2.0
   24    29    33    43   0.57400  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   0.30150 -1.0 2.0
   29    33    37    39   0.30150 -1.0 2.0
   29    33    40    41   0.15000  1.0 3.0
   29    33    40    42   0.15000  1.0 3.0
   29    33    40    45   0.44750  1.0 1.0
   29    33    40    45  -0.17800 -1.0 2.0
   29    33    40    45   0.20200  1.0 3.0
   29    33    43    44   0.35600  1.0 1.0
   29    33    43    44  -0.10750 -1.0 2.0
   29    33    43    44  -0.54400  1.0 3.0
   33    40    45    46   0.56750  1.0 1.0
   33    40    45    46  -0.07550 -1.0 2.0
   33    40    45    46   0.20000  1.0 3.0
   33    40    45    49   0.56750  1.0 1.0
   33    40    45    49  -0.07550 -1.0 2.0
   33    40    45    49   0.20000  1.0 3.0
   33    40    45    52   0.86500  1.0 1.0
   33    40    45    52  -0.17500 -1.0 2.0
   33    40    45    52   0.20800  1.0 3.0
   37    33    40    41  -0.11250  1.0 3.0
   37    33    40    42  -0.11250  1.0 3.0
   37    33    40    45  -1.63150  1.0 1.0
   37    33    40    45  -0.43550 -1.0 2.0
   37    33    40    45   0.24500  1.0 3.0
   37    33    43    44   0.91850  1.0 1.0
   37    33    43    44   0.57950  1.0 3.0
   40    33    37    38   0.41150 -1.0 2.0
   40    33    37    39   0.41150 -1.0 2.0
   40    33    43    44  -0.11600  1.0 1.0
   40    33    43    44  -0.09450 -1.0 2.0
   40    33    43    44   0.21250  1.0 3.0
   40    45    46    47   0.15000  1.0 3.0
   40    45    46    48   0.15000  1.0 3.0
   40    45    46    54   0.86500  1.0 1.0
   40    45    46    54  -0.17500 -1.0 2.0
   40    45    46    54   0.20800  1.0 3.0
   40    45    49    50   0.15000  1.0 3.0
   40    45    49    51   0.15000  1.0 3.0
   40    45    49    56   0.62750  1.0 1.0
   40    45    49    56  -0.30950 -1.0 2.0
   40    45    49    56   0.27300  1.0 3.0
   40    45    52    53  -0.11600  1.0 1.0
   40    45    52    53  -0.09450 -1.0 2.0
   40    45    52    53   0.21250  1.0 3.0
   41    40    45    46   0.15000  1.0 3.0
   41    40    45    49   0.15000  1.0 3.0
   41    40    45    52   0.23400  1.0 3.0
   42    40    45    46   0.15000  1.0 3.0
   42    40    45    49   0.15000  1.0 3.0
   42    40    45    52   0.23400  1.0 3.0
   45    46    54    55  -0.11600  1.0 1.0
   45    46    54    55  -0.09450 -1.0 2.0
   45    46    54    55   0.21250  1.0 3.0
   45    49    56    57  -2.65550  1.0 1.0
   45    49    56    57  -0.22350 -1.0 2.0
   45    49    56    57   0.24150  1.0 3.0
   46    45    49    50   0.15000  1.0 3.0
   46    45    49    51   0.15000  1.0 3.0
   46    45    49    56   0.62750  1.0 1.0
   46    45    49    56  -0.30950 -1.0 2.0
   46    45    49    56   0.27300  1.0 3.0
   46    45    52    53  -0.11600  1.0 1.0
   46    45    52    53  -0.09450 -1.0 2.0
   46    45    52    53   0.21250  1.0 3.0
   47    46    54    55   0.19450  1.0 3.0
   48    46    54    55   0.19450  1.0 3.0
   49    45    46    47   0.15000  1.0 3.0
   49    45    46    48   0.15000  1.0 3.0
   49    45    46    54   0.86500  1.0 1.0
   49    45    46    54  -0.17500 -1.0 2.0
   49    45    46    54   0.20800  1.0 3.0
   49    45    52    53  -0.11600  1.0 1.0
   49    45    52    53  -0.09450 -1.0 2.0
   49    45    52    53   0.21250  1.0 3.0
   49    56    57    58   0.00000  1.0 1.0
   49    56    57    59   0.00000  1.0 1.0
   49    56    57    60   0.05050  1.0 1.0
   49    56    57    60  -1.30700 -1.0 2.0
   49    56    57    60   0.91550  1.0 3.0
   50    49    56    57   0.03000  1.0 3.0
   51    49    56    57   0.03000  1.0 3.0
   56    57    60    61   0.00000  1.0 1.0
   58    57    60    61   0.00000  1.0 1.0
   59    57    60    61   0.00000  1.0 1.0
   52    45    46    47   0.23400  1.0 3.0
   52    45    46    48   0.23400  1.0 3.0
   52    45    46    54   3.75450  1.0 1.0
   52    45    49    50   0.23400  1.0 3.0
   52    45    49    51   0.23400  1.0 3.0
   52    45    49    56   3.69350  1.0 1.0
   52    45    49    56  -1.82950 -1.0 2.0
   43    33    37    38   0.30150 -1.0 2.0
   43    33    37    39   0.30150 -1.0 2.0
   43    33    40    41   0.23400  1.0 3.0
   43    33    40    42   0.23400  1.0 3.0
   43    33    40    45   0.86500  1.0 1.0
   43    33    40    45  -0.17500 -1.0 2.0
   43    33    40    45   0.20800  1.0 3.0
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
   38    33    37    39  10.50000 -1.0 2.0
END
