* LIGAND DATABASE FILE (OPLS2005)
*
001      66    67    114    173     327
    1     0 S   NP   _N1_     1    28.79868    96.64209   -23.80240
    2     1 S   H    _HN1     2     1.02787   108.48133   -94.50924
    3     1 S   H    _H1_     3     1.02949    71.71601     9.34473
    4     1 S   H    _H2_     4     1.02828    37.32316   169.99380
    5     1 S   CT   _CA1     5     1.50114   135.52923   110.15856
    6     5 S   HC   _HA1     6     1.09573   105.19017    93.35037
    7     5 S   CO3  _C1_     7     1.53783   112.46650   -26.88446
    8     7 S   O2Z  _O11     8     1.26373   115.00545   -42.52400
    9     7 S   O2Z  _O12     9     1.26240   114.94496   136.59384
   10     5 S   CT   _CB1    10     1.53077   107.41858  -148.66557
   11    10 S   HC   HB11    11     1.09835   109.36241   -49.65457
   12    10 S   HC   HB12    12     1.09813   110.45397    66.94953
   13    10 S   CT   _CG1    13     1.52998   112.61469  -170.62286
   14    13 S   HC   HG11    14     1.09579   110.65564   -66.03726
   15    13 S   HC   HG12    15     1.09671   109.76360    53.19843
   16    13 S   C    _CD1    16     1.51803   112.17966   173.66049
   17    16 S   O    _OE1    17     1.22737   123.27354     8.22820
   18    16 S   N    _N2_    18     1.38662   111.71293  -171.87233
   19    18 S   H    _HN2    19     1.01585   118.93100     1.63279
   20    18 S   CT1  _CA2    20     1.46179   123.36131   177.10389
   21    20 S   HC   _HA2    21     1.09737   109.34279     3.83472
   22    20 S   C    _C2_    22     1.53579   108.73541  -111.65397
   23    22 S   O    _O2_    23     1.23068   122.21991  -148.51912
   24    20 S   CT   _CB2    32     1.53323   111.61200   125.84033
   25    24 S   HC   HB21    33     1.09539   110.03698    56.45051
   26    24 S   HC   HB22    34     1.09527   110.12211   175.46439
   27    22 S   N    _N3_    24     1.38306   113.77228    38.95284
   28    27 S   H    _HN3    25     1.01576   119.60790    -3.33049
   29    24 S   S    _SG2    35     1.82719   111.57962   -64.85054
   30    27 S   CT   _CA3    26     1.45291   123.24336   177.14110
   31    30 S   HC   HA31    27     1.09548   107.51258   -64.63033
   32    30 S   HC   HA32    28     1.09556   107.98827    51.81757
   33    29 S   CT   _C17    36     1.82098    99.32532  -177.21617
   34    33 S   Cl   Cl1_    37     1.78833   110.84757   -74.77458
   35    33 S   HC   _H3_    38     1.08953   111.55852    42.54105
   36    30 S   CO3  _C3_    29     1.52969   114.05832   173.81119
   37    36 S   O2Z  _O31    30     1.26379   116.06263    -0.62776
   38    36 S   O2Z  _O32    31     1.26426   114.41634   179.43386
   39    33 S   C    _C16    39     1.53153   107.95253   166.60105
   40    39 S   O    _O36    40     1.23583   119.15926    84.78445
   41    39 S   N    _N4_    41     1.41478   116.79805   -96.69579
   42    41 S   CA   _C5_    42     1.44691   121.08260  -177.89559
   43    41 S   CT   _C4_    63     1.46964   122.43103    -1.15471
   44    43 S   HC   _H4_    64     1.09396   108.79157   -82.99883
   45    43 S   HC   _H5_    65     1.09450   111.32582   154.89082
   46    43 S   HC   _H6_    66     1.09204   110.95804    37.24914
   47    42 S   CA   _C6_    43     1.40661   121.76826   -31.84265
   48    47 S   HA   _H7_    44     1.08608   121.60445    -2.85142
   49    47 S   CA   _C7_    45     1.39800   121.28637  -179.79252
   50    49 S   HA   _H8_    46     1.08593   119.94130   179.16866
   51    49 S   CA   _C8_    47     1.38963   119.30363    -0.36477
   52    51 S   CA   _C9_    48     1.38951   121.10248     1.60425
   53    52 S   HA   _H9_    49     1.08582   120.78716   178.95601
   54    51 S   OS   _O33    52     1.39636   119.31805   178.34129
   55    42 S   CA   _C10    50     1.40949   120.49460   149.29031
   56    55 S   HA   _H10    51     1.08716   121.27756    -2.09069
   57    54 S   CO4  _C11    53     1.39241   113.36676    93.18595
   58    57 S   O    _O34    54     1.22563   125.68508    -0.02798
   59    57 S   C5A  _C12    55     1.43812   109.13419   179.98022
   60    59 S   C5BC _C13    56     1.38260   133.01880     0.02798
   61    60 S   HA   _H11    57     1.08117   126.32392     0.00000
   62    60 S   C5BC _C14    58     1.41554   106.70492   180.00000
   63    62 S   HA   _H12    59     1.08049   127.60629  -179.98022
   64    62 S   C5A  _C15    60     1.37375   106.09126     0.00000
   65    64 S   HA   _H13    61     1.08035   133.80970  -180.00000
   66    59 S   OA   _O35    62     1.36780   117.57407  -179.98022
  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   6   5   4   3
   7   4   3   2   1   1   9   3  11  13   5   2   1   1   8   4
   7   3   8   5   3   6   1   1   7   3   7   6   4   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    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  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    42    43  
   35    39    40    41  
   39    40    41  
   37    38  
   38  
    0  
   40    41    42    47    55    43    44    45    46  
   41    42    43  
   42    47    48    49    52    55    56    43    44    45    46  
   47    48    49    50    51    52    53    55    56    43    44    45    46  
   44    45    46    47    55  
   45    46  
   46  
    0  
   48    49    50    51    52    55    56    54  
   49    50    51    55  
   50    51    52    53    55    54    57  
   51    52    54  
   52    53    55    56    54    57    58    59  
   53    55    56    54    57  
   55    56    54  
   57    58    59    60    66    55  
   56  
    0  
   58    59    60    61    62    64    66  
   59    60    66  
   60    61    62    63    64    65    66  
   61    62    63    64    65    66  
   62    63    64    66  
   63    64    65    66  
   64    65    66  
   65    66  
   66  
    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   0.104500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   35   2.5000   0.0300   0.103000   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   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   40   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   41   3.2500   0.1700  -0.031700   1.8100   1.6000   0.054801302  -1.445846770
   42   3.5500   0.0700  -0.038300   2.5000   1.7750   0.001000000  -0.843144165
   43   3.5000   0.0660  -0.110000   1.9750   1.7500   0.005000000  -0.741685710
   44   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   47   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   51   3.5500   0.0700   0.135000   2.5000   1.7750   0.001000000  -0.843144165
   52   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   53   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   54   3.0000   0.1700  -0.215000   1.7660   1.5600   0.020110767  -0.896042159
   55   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   56   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   57   3.7500   0.1050   0.625000   2.1120   1.8750   0.001000000  -0.126889456
   58   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   59   3.5500   0.0700   0.008000   2.0020   1.7750   0.001000000  -0.843144165
   60   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   64   3.5500   0.0700  -0.019000   2.0020   1.7750   0.001000000  -0.843144165
   65   2.4200   0.0300   0.142000   1.3810   1.2100   0.030040813   0.268726247
   66   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
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   245.000  1.781
   33    35   340.000  1.090
   33    39   317.000  1.522
   39    40   570.000  1.229
   39    41   490.000  1.335
   41    42   360.000  1.404
   41    43   337.000  1.449
   42    47   469.000  1.400
   42    55   469.000  1.400
   47    48   367.000  1.080
   47    49   469.000  1.400
   49    50   367.000  1.080
   49    51   469.000  1.400
   51    52   469.000  1.400
   51    54   450.000  1.364
   52    53   367.000  1.080
   52    55   469.000  1.400
   55    56   367.000  1.080
   54    57   214.000  1.327
   57    58   570.000  1.229
   57    59   335.000  1.450
   59    60   546.000  1.367
   59    66   340.000  1.360
   60    61   367.000  1.080
   60    62   469.000  1.424
   62    63   367.000  1.080
   62    64   546.000  1.367
   64    65   367.000  1.080
   64    66   340.000  1.360
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    46   340.000  1.090
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    85.00000  110.65400
   29    33    35    35.00000  109.50000
   29    33    39    70.00000  112.33000
   33    39    40    80.00000  120.40000
   33    39    41    70.00000  116.60000
   35    33    34    51.00000  107.60000
   39    33    34    75.00000  109.32700
   39    33    35    35.00000  109.50000
   39    41    42    65.00000  121.96500
   39    41    43    50.00000  121.90000
   41    39    40    80.00000  122.90000
   41    42    47    70.00000  119.01900
   41    42    55    70.00000  119.01900
   41    43    44    35.00000  109.50000
   41    43    45    35.00000  109.50000
   41    43    46    35.00000  109.50000
   42    47    48    35.00000  120.00000
   42    47    49    63.00000  120.00000
   42    55    52    63.00000  120.00000
   42    55    56    35.00000  120.00000
   47    49    50    35.00000  120.00000
   47    49    51    63.00000  120.00000
   49    47    48    35.00000  120.00000
   49    51    52    63.00000  120.00000
   49    51    54    70.00000  120.00000
   51    49    50    35.00000  120.00000
   51    52    53    35.00000  120.00000
   51    52    55    63.00000  120.00000
   51    54    57    85.00000  115.98000
   52    55    56    35.00000  120.00000
   55    42    47    63.00000  120.00000
   55    52    53    35.00000  120.00000
   54    51    52    70.00000  120.00000
   54    57    58    83.00000  123.40000
   54    57    59    81.00000  111.40000
   57    59    60    55.00000  130.80000
   57    59    66    80.00000  119.06000
   59    57    58    80.00000  122.40000
   59    60    61    35.00000  125.70000
   59    60    62    70.00000  107.30000
   59    66    64    70.00000  106.50000
   60    62    63    35.00000  127.50000
   60    62    64    70.00000  107.30000
   62    60    61    35.00000  127.50000
   62    64    65    35.00000  132.10000
   62    64    66    70.00000  110.60000
   64    62    63    35.00000  125.70000
   66    59    60    70.00000  110.60000
   66    64    65    35.00000  113.40000
   43    41    42    70.00000  121.06000
   45    43    44    33.00000  107.80000
   46    43    44    33.00000  107.80000
   46    43    45    33.00000  107.80000
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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  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   0.30150 -1.0 2.0
   29    33    39    41   0.00000  1.0 1.0
   33    39    41    42   0.76000  1.0 1.0
   33    39    41    42   4.11600 -1.0 2.0
   33    39    41    43   1.49850  1.0 1.0
   33    39    41    43   1.53950 -1.0 2.0
   34    33    39    40   0.30150 -1.0 2.0
   34    33    39    41   0.00000  1.0 1.0
   35    33    39    40   0.00000  1.0 1.0
   35    33    39    41   0.00000  1.0 1.0
   39    41    42    47   1.00100  1.0 1.0
   39    41    42    47   0.85050 -1.0 2.0
   39    41    42    55   1.00100  1.0 1.0
   39    41    42    55   0.85050 -1.0 2.0
   39    41    43    44   0.00000  1.0 1.0
   39    41    43    45   0.00000  1.0 1.0
   39    41    43    46   0.00000  1.0 1.0
   40    39    41    42   0.04000 -1.0 2.0
   40    39    41    43   3.04450 -1.0 2.0
   41    42    47    48   3.62500 -1.0 2.0
   41    42    47    49   3.62500 -1.0 2.0
   41    42    55    52   3.62500 -1.0 2.0
   41    42    55    56   3.62500 -1.0 2.0
   42    41    43    44   0.00000  1.0 1.0
   42    41    43    45   0.00000  1.0 1.0
   42    41    43    46   0.00000  1.0 1.0
   42    47    49    50   3.62500 -1.0 2.0
   42    47    49    51   3.62500 -1.0 2.0
   47    42    55    52   3.62500 -1.0 2.0
   47    42    55    56   3.62500 -1.0 2.0
   47    49   -51    52   3.62500 -1.0 2.0
   47    49    51    54   3.62500 -1.0 2.0
   48    47    49    50   3.62500 -1.0 2.0
   48    47    49    51   3.62500 -1.0 2.0
   49    51    52    53   3.62500 -1.0 2.0
   49    51    52    55   3.62500 -1.0 2.0
   49    51    54    57   0.01300  1.0 1.0
   49    51    54    57   0.97950 -1.0 2.0
   49    51    54    57  -0.55700  1.0 3.0
   50    49    51    52   3.62500 -1.0 2.0
   50    49    51    54   3.62500 -1.0 2.0
   51    52   -55    42   3.62500 -1.0 2.0
   51    52    55    56   3.62500 -1.0 2.0
   51    54    57    58   3.00000 -1.0 2.0
   51    54    57    59   2.00000 -1.0 2.0
   52    51    54    57   0.01300  1.0 1.0
   52    51    54    57   0.97950 -1.0 2.0
   52    51    54    57  -0.55700  1.0 3.0
   53    52    55    42   3.62500 -1.0 2.0
   53    52    55    56   3.62500 -1.0 2.0
   55    42    47    48   3.62500 -1.0 2.0
   55    42   -47    49   3.62500 -1.0 2.0
   54    51    52    53   3.62500 -1.0 2.0
   54    51    52    55   3.62500 -1.0 2.0
   54    57    59    60   0.98750 -1.0 2.0
   54    57    59    66   0.56600 -1.0 2.0
   57    59    60    61   3.62500 -1.0 2.0
   57    59    60    62   3.62500 -1.0 2.0
   57    59    66    64   3.62500 -1.0 2.0
   58    57    59    60   1.05000 -1.0 2.0
   58    57    59    66   1.05000 -1.0 2.0
   59    60    62    63   3.62500 -1.0 2.0
   59    60   -62    64   3.62500 -1.0 2.0
   60    59   -66    64   3.62500 -1.0 2.0
   60    62    64    65   3.62500 -1.0 2.0
   60    62   -64    66   3.62500 -1.0 2.0
   61    60    62    63   3.62500 -1.0 2.0
   61    60    62    64   3.62500 -1.0 2.0
   62    64   -66    59   3.62500 -1.0 2.0
   63    62    64    65   3.62500 -1.0 2.0
   63    62    64    66   3.62500 -1.0 2.0
   65    64    66    59   3.62500 -1.0 2.0
   66    59    60    61   3.62500 -1.0 2.0
   66    59   -60    62   3.62500 -1.0 2.0
   43    41    42    47   0.81400  1.0 1.0
   43    41    42    47   1.55550 -1.0 2.0
   43    41    42    55   0.81400  1.0 1.0
   43    41    42    55   1.55550 -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
   33    41    39    40  10.50000 -1.0 2.0
   43    39    41    42   1.00000 -1.0 2.0
   47    55    42    41   4.00000 -1.0 2.0
   49    48    47    42   1.10000 -1.0 2.0
   51    50    49    47   1.10000 -1.0 2.0
   52    54    51    49   4.00000 -1.0 2.0
   55    53    52    51   1.10000 -1.0 2.0
   52    56    55    42   1.10000 -1.0 2.0
   54    59    57    58  10.50000 -1.0 2.0
   60    66    59    57   4.00000 -1.0 2.0
   62    61    60    59   1.10000 -1.0 2.0
   64    63    62    60   1.10000 -1.0 2.0
   66    65    64    62   1.10000 -1.0 2.0
END
