* LIGAND DATABASE FILE (OPLS2005)
*
001      60    62    109    177     321
    1     0 S   NP   _N1_     1    28.80057    95.84241   -24.36970
    2     1 S   H    _HN1     2     1.02787   110.78272   -92.58027
    3     1 S   H    _H1_     3     1.02949    75.07032    11.75778
    4     1 S   H    _H2_     4     1.02828    33.15435   176.28132
    5     1 S   CT   _CA1     5     1.50110   131.66147   115.98501
    6     5 S   HC   _HA1     6     1.09572   105.19360    89.76189
    7     5 S   CO3  _C1_     7     1.53793   112.48387   -30.47347
    8     7 S   O2Z  _O11     8     1.26372   115.00902   -42.09813
    9     7 S   O2Z  _O12     9     1.26242   114.95084   137.05293
   10     5 S   CT   _CB1    10     1.53081   107.42170  -152.24471
   11    10 S   HC   HB11    11     1.09832   109.38215   -49.61973
   12    10 S   HC   HB12    12     1.09812   110.44249    66.99724
   13    10 S   CT   _CG1    13     1.52983   112.59759  -170.59443
   14    13 S   HC   HG11    14     1.09583   110.62374   -65.55890
   15    13 S   HC   HG12    15     1.09670   109.78678    53.66727
   16    13 S   C    _CD1    16     1.51798   112.25247   174.13221
   17    16 S   O    _OE1    17     1.22728   123.28813     6.62543
   18    16 S   N    _N2_    18     1.38643   111.63510  -173.39948
   19    18 S   H    _HN2    19     1.01570   118.94335     1.87074
   20    18 S   CT1  _CA2    20     1.46248   123.48194   177.95646
   21    20 S   HC   _HA2    21     1.09736   109.33306     4.41952
   22    20 S   C    _C2_    22     1.53596   108.66720  -111.08144
   23    22 S   O    _O2_    23     1.23059   122.31925  -148.19799
   24    20 S   CT   _CB2    32     1.53361   111.46887   126.37853
   25    24 S   HC   HB21    33     1.09583   109.94923    56.12928
   26    24 S   HC   HB22    34     1.09416   110.15290   175.11970
   27    22 S   N    _N3_    24     1.38348   113.74743    39.28381
   28    27 S   H    _HN3    25     1.01569   119.57946    -3.24830
   29    24 S   S    _SG2    35     1.82809   111.33526   -64.58799
   30    27 S   CT   _CA3    26     1.45286   123.23500   177.15126
   31    30 S   HC   HA31    27     1.09548   107.50203   -64.85590
   32    30 S   HC   HA32    28     1.09556   107.99955    51.59057
   33    29 S   CT   _C17    36     1.86463    99.43929   172.41297
   34    33 S   HC   _H4_    37     1.09951   105.98749   -41.81372
   35    30 S   CO3  _C3_    29     1.52965   114.06867   173.59271
   36    35 S   O2Z  _O31    30     1.26377   116.06713    -0.71764
   37    35 S   O2Z  _O32    31     1.26426   114.41649   179.34658
   38    33 S   CA   _C12    38     1.52700   107.54711  -157.30312
   39    38 S   CA   _C11    39     1.39951   119.00793    82.84535
   40    39 S   HA   _H10    40     1.08728   120.39977     1.64580
   41    38 S   CA   _C13    53     1.41474   121.12362   -95.08136
   42    39 S   CA   _C10    41     1.39023   120.46577  -177.80411
   43    42 S   HA   _H9_    42     1.08833   118.44817   179.80218
   44    41 S   CM   _C14    54     1.47616   117.62291    -2.15104
   45    44 S   HC   _H11    55     1.08231   119.73237   166.58582
   46    42 S   CA   _C8_    43     1.39954   120.89984    -0.03426
   47    44 S   CM   _C15    56     1.34201   121.67558   -15.29041
   48    47 S   HC   _H12    57     1.08826   118.58724  -178.29601
   49    46 S   CA   _C9_    44     1.40533   119.37647   180.00000
   50    49 S   HA   _H8_    45     1.08855   120.47839    -0.25564
   51    33 S   CT   _C16    58     1.56510   110.87466    77.74195
   52    51 S   OM   _O33    59     1.32526   108.86552  -157.68692
   53    51 S   HC   _H3_    60     1.09886   107.36627   -29.06426
   54    49 S   CA   _C4_    46     1.39181   121.08831   179.64723
   55    54 S   HA   _H5_    47     1.08584   120.15648  -179.95154
   56    54 S   CA   _C5_    48     1.38635   119.59115    -0.12354
   57    56 S   HA   _H6_    49     1.08623   120.11197  -179.73312
   58    56 S   CA   _C6_    50     1.39757   119.98245     0.16432
   59    58 S   HA   _H7_    51     1.08657   116.73019  -179.56704
   60    46 S   CA   _C7_    52     1.42037   120.15699    -0.14402
  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   9   5   4   3
  13   7   2   1   1  14   9   4  12   7   3   9   4   8   5   3
   7   4   2   1   1   6   3   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    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    51    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    47    51    52    53  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    42    60    41    44    47    48    51    52    53  
   38    39    41    47    51    52    53  
   36    37  
   37  
    0  
   39    40    42    43    46    58    60    41    44    45    47    51    52    53  
   40    42    43    46    49    60    41    44    51  
   42    43    46    41  
   44    45    47    48    51    42    46    49    56    58    59    60  
   43    46    49    50    54    58    60  
   46    49    60  
   45    47    48    51    52    53    46    58    60  
   47    48    51    60  
   49    50    54    55    56    58    59    60  
   48    51    52    53    60  
   51    52    53  
   50    54    55    56    57    58    60  
   54    55    56    60  
   52    53  
   53  
    0  
   55    56    57    58    59    60  
   56    57    58  
   57    58    59    60  
   58    59    60  
   59    60  
   60  
    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   0.222500   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   39   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   40   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   41   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   42   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   48   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   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   4.2000   0.3000  -0.080000   1.9750   1.7500   0.005000000  -0.741685710
   52   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   53   2.5000   0.0500   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   57   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   58   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   59   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   60   3.5500   0.0700   0.000000   2.5000   1.7750   0.001000000  -0.843144165
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    35   317.000  1.522
   35    36   656.000  1.250
   35    37   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    38   317.000  1.510
   33    51   268.000  1.529
   38    39   469.000  1.400
   38    41   469.000  1.400
   39    40   367.000  1.080
   39    42   469.000  1.400
   42    43   367.000  1.080
   42    46   469.000  1.400
   46    49   469.000  1.400
   46    60   469.000  1.400
   49    50   367.000  1.080
   49    54   469.000  1.400
   54    55   367.000  1.080
   54    56   469.000  1.400
   56    57   367.000  1.080
   56    58   469.000  1.400
   58    59   367.000  1.080
   58    60   469.000  1.400
   60    41   469.000  1.400
   41    44   320.000  1.460
   44    45   340.000  1.080
   44    47   549.000  1.340
   47    48   340.000  1.080
   47    51   317.000  1.510
   51    52   570.000  1.307
   51    53   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    35    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    35    36    70.00000  117.00000
   30    35    37    70.00000  117.00000
   32    30    31    33.00000  107.80000
   35    30    31    35.00000  109.50000
   35    30    32    35.00000  109.50000
   37    35    36    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    38    80.00000  109.48900
   29    33    51    75.00000  111.63000
   33    38    39    70.00000  120.00000
   33    38    41    70.00000  120.00000
   33    51    47    70.00000  112.02700
   33    51    52    50.00000  109.50000
   33    51    53    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    39    40    35.00000  120.00000
   38    39    42    63.00000  120.00000
   38    41    60    63.00000  120.00000
   38    41    44    60.00000  120.93500
   39    42    43    35.00000  120.00000
   39    42    46    63.00000  120.00000
   42    39    40    35.00000  120.00000
   42    46    49    63.00000  120.00000
   42    46    60    63.00000  120.00000
   46    42    43    35.00000  120.00000
   46    49    50    35.00000  120.00000
   46    49    54    63.00000  120.00000
   46    60    58    63.00000  120.00000
   46    60    41    63.00000  120.00000
   49    54    55    35.00000  120.00000
   49    54    56    63.00000  120.00000
   54    49    50    35.00000  120.00000
   54    56    57    35.00000  120.00000
   54    56    58    63.00000  120.00000
   56    54    55    35.00000  120.00000
   56    58    59    35.00000  120.00000
   56    58    60    63.00000  120.00000
   58    56    57    35.00000  120.00000
   58    60    41    63.00000  120.00000
   60    46    49    63.00000  120.00000
   60    58    59    35.00000  120.00000
   60    41    44    60.00000  120.93500
   41    38    39    63.00000  120.00000
   41    44    45    40.00000  117.26300
   41    44    47    60.00000  123.20500
   44    47    48    35.00000  120.00000
   44    47    51    70.00000  124.00000
   47    44    45    35.00000  120.00000
   47    51    52    85.00000  110.90400
   47    51    53    35.00000  109.50000
   51    33    34    37.50000  110.70000
   51    33    38    70.00000  112.17500
   51    47    48    35.00000  117.00000
   53    51    52    45.00000  125.66300
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    35  -0.29800  1.0 1.0
   22    27    30    35   0.13950 -1.0 2.0
   22    27    30    35  -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    35    36   0.00000  1.0 1.0
   27    30    35    37   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    35   0.00000  1.0 1.0
   31    30    35    36   0.00000  1.0 1.0
   31    30    35    37   0.00000  1.0 1.0
   32    30    35    36   0.00000  1.0 1.0
   32    30    35    37   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    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    51   0.01700  1.0 1.0
   24    29    33    51  -0.23550 -1.0 2.0
   24    29    33    51   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    38    39  -0.16000  1.0 1.0
   29    33    38    39  -0.03200 -1.0 2.0
   29    33    38    39   0.04500  1.0 3.0
   29    33    38    41  -0.16000  1.0 1.0
   29    33    38    41  -0.03200 -1.0 2.0
   29    33    38    41   0.04500  1.0 3.0
   29    33    51    47   0.56750  1.0 1.0
   29    33    51    47  -0.07550 -1.0 2.0
   29    33    51    47   0.20000  1.0 3.0
   29    33    51    52   0.56750  1.0 1.0
   29    33    51    52  -0.07550 -1.0 2.0
   29    33    51    52   0.20000  1.0 3.0
   29    33    51    53   0.15000  1.0 3.0
   33    38    39    40   3.62500 -1.0 2.0
   33    38    39    42   3.62500 -1.0 2.0
   33    38    41    60   3.62500 -1.0 2.0
   33    38    41    44   3.62500 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    41   0.00000  1.0 1.0
   34    33    51    47   0.15000  1.0 3.0
   34    33    51    52   0.23400  1.0 3.0
   34    33    51    53   0.15000  1.0 3.0
   38    33    51    47   0.21200  1.0 1.0
   38    33    51    47   0.16900 -1.0 2.0
   38    33    51    47  -1.15100  1.0 3.0
   38    33    51    52  -0.64350  1.0 1.0
   38    33    51    52  -0.04200 -1.0 2.0
   38    33    51    52   0.19800  1.0 3.0
   38    33    51    53   0.43200  1.0 3.0
   38    39    42    43   3.62500 -1.0 2.0
   38    39    42    46   3.62500 -1.0 2.0
   38    41    44    45   0.56550  1.0 3.0
   38    41   -44    47   0.15800  1.0 1.0
   38    41   -44    47   1.85350 -1.0 2.0
   38    41   -44    47  -0.48700  1.0 3.0
   39    38    41    60   3.62500 -1.0 2.0
   39    38    41    44   3.62500 -1.0 2.0
   39    42    46    49   3.62500 -1.0 2.0
   39    42   -46    60   3.62500 -1.0 2.0
   40    39    42    43   3.62500 -1.0 2.0
   40    39    42    46   3.62500 -1.0 2.0
   42    46    49    50   3.62500 -1.0 2.0
   42    46    49    54   3.62500 -1.0 2.0
   42    46    60    58   3.62500 -1.0 2.0
   42    46    60    41   3.62500 -1.0 2.0
   43    42    46    49   3.62500 -1.0 2.0
   43    42    46    60   3.62500 -1.0 2.0
   46    49    54    55   3.62500 -1.0 2.0
   46    49    54    56   3.62500 -1.0 2.0
   46    60   -41    38   3.62500 -1.0 2.0
   46    60    41    44   3.62500 -1.0 2.0
   49    46    60    58   3.62500 -1.0 2.0
   49    46    60    41   3.62500 -1.0 2.0
   49    54    56    57   3.62500 -1.0 2.0
   49    54   -56    58   3.62500 -1.0 2.0
   50    49    54    55   3.62500 -1.0 2.0
   50    49    54    56   3.62500 -1.0 2.0
   54    56    58    59   3.62500 -1.0 2.0
   54    56    58    60   3.62500 -1.0 2.0
   55    54    56    57   3.62500 -1.0 2.0
   55    54    56    58   3.62500 -1.0 2.0
   56    58   -60    46   3.62500 -1.0 2.0
   56    58    60    41   3.62500 -1.0 2.0
   57    56    58    59   3.62500 -1.0 2.0
   57    56    58    60   3.62500 -1.0 2.0
   58    60    41    38   3.62500 -1.0 2.0
   58    60    41    44   3.62500 -1.0 2.0
   59    58    60    46   3.62500 -1.0 2.0
   59    58    60    41   3.62500 -1.0 2.0
   60    46    49    50   3.62500 -1.0 2.0
   60    46   -49    54   3.62500 -1.0 2.0
   60    41    44    45   0.56550  1.0 3.0
   60    41    44    47   0.15800  1.0 1.0
   60    41    44    47   1.85350 -1.0 2.0
   60    41    44    47  -0.48700  1.0 3.0
   41    38    39    40   3.62500 -1.0 2.0
   41    38   -39    42   3.62500 -1.0 2.0
   41    44    47    48   7.00000 -1.0 2.0
   41    44    47    51   7.00000 -1.0 2.0
   44    47   -51    33   0.09850  1.0 1.0
   44    47   -51    33   0.15250 -1.0 2.0
   44    47   -51    33  -0.50650  1.0 3.0
   44    47    51    52   0.39000  1.0 1.0
   44    47    51    52  -0.05800 -1.0 2.0
   44    47    51    52  -0.55150  1.0 3.0
   44    47    51    53   0.00000  1.0 1.0
   45    44    47    48   7.00000 -1.0 2.0
   45    44    47    51   7.00000 -1.0 2.0
   48    47    51    33   0.00000  1.0 1.0
   48    47    51    52   0.00000  1.0 1.0
   48    47    51    53   0.33100  1.0 3.0
   51    33    38    39   0.04150 -1.0 2.0
   51    33   -38    41   0.04150 -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
   36    30    35    37  10.50000 -1.0 2.0
   39    41    38    33   4.00000 -1.0 2.0
   42    40    39    38   1.10000 -1.0 2.0
   46    43    42    39   1.10000 -1.0 2.0
   49    60    46    42   4.00000 -1.0 2.0
   54    50    49    46   1.10000 -1.0 2.0
   56    55    54    49   1.10000 -1.0 2.0
   58    57    56    54   1.10000 -1.0 2.0
   60    59    58    56   1.10000 -1.0 2.0
   58    41    60    46   4.00000 -1.0 2.0
   60    44    41    38   4.00000 -1.0 2.0
   41    45    44    47   1.10000 -1.0 2.0
   51    48    47    44   1.10000 -1.0 2.0
END
