* LIGAND DATABASE FILE (OPLS2005)
*
001      61    60    103    154     304
    1     0 S   NP   _N1_     1    29.10185    93.90461   -22.95268
    2     1 S   H    _HN1     2     1.02845    25.29203   132.70716
    3     1 S   H    _H1_     3     1.02817    98.32940  -113.11899
    4     1 S   H    _H2_     4     1.02921    88.78260    -4.88415
    5     1 S   CT   _CA1     5     1.50045   135.07946   113.76086
    6     5 S   HC   _HA1     6     1.09563   105.26464    68.26296
    7     5 S   CO3  _C1_     7     1.53792   112.43044   -52.29013
    8     7 S   O2Z  _O11     8     1.26440   115.11697   -47.95535
    9     7 S   O2Z  _O12     9     1.26174   115.06458   131.38659
   10     5 S   CT   _CB1    10     1.53062   107.49691  -173.56666
   11    10 S   HC   HB11    11     1.09829   109.74497   -47.99578
   12    10 S   HC   HB12    12     1.09812   110.38539    68.71753
   13    10 S   CT   _CG1    13     1.52975   112.32989  -168.78316
   14    13 S   HC   HG11    14     1.09588   110.73649   -60.90828
   15    13 S   HC   HG12    15     1.09651   109.75725    58.32953
   16    13 S   C    _CD1    16     1.51679   112.07277   179.23792
   17    16 S   O    _OE1    17     1.22740   123.14124    10.86345
   18    16 S   N    _N2_    18     1.38624   111.76938  -170.27312
   19    18 S   H    _HN2    19     1.01567   119.18523     3.23095
   20    18 S   CT1  _CA2    20     1.46086   123.17928  -178.35111
   21    20 S   HC   _HA2    21     1.09563   109.15397     0.20367
   22    20 S   C    _C2_    22     1.53447   109.16724  -114.98196
   23    22 S   O    _O2_    23     1.23060   122.17267  -150.26395
   24    20 S   CT   _CB2    32     1.53435   111.69174   122.24982
   25    24 S   HC   HB21    33     1.09657   109.53760    67.44662
   26    24 S   HC   HB22    34     1.09569   110.88853  -175.24503
   27    22 S   N    _N3_    24     1.38300   113.70432    37.21849
   28    27 S   H    _HN3    25     1.01600   119.50392    -3.44725
   29    24 S   S    _SG2    35     1.82829   114.47612   -51.84137
   30    27 S   CT   _CA3    26     1.45276   123.23975   177.02435
   31    30 S   HC   HA31    27     1.09549   107.52729   -64.14140
   32    30 S   HC   HA32    28     1.09556   107.96845    52.29542
   33    29 S   CT   _C8_    36     1.83595   100.08060   -69.14807
   34    33 S   HC   _H7_    37     1.09466   108.69766    47.95878
   35    33 S   HC   _H8_    38     1.09674   107.35075   -67.81423
   36    30 S   CO3  _C3_    29     1.52958   114.06525   174.28163
   37    36 S   O2Z  _O31    30     1.26377   116.06047    -0.64559
   38    36 S   O2Z  _O32    31     1.26424   114.41754   179.41516
   39    33 S   CT   _C7_    39     1.54498   113.16448   169.83361
   40    39 S   CM   _C6_    40     1.52443   110.58733   -67.67135
   41    40 S   HC   _H6_    41     1.09046   114.99818   -60.32539
   42    39 S   CO3  _C9_    56     1.56997   111.46338   176.62171
   43    42 S   O2Z  _O34    57     1.26477   116.13867     6.36137
   44    42 S   O2Z  _O33    58     1.26887   115.36924  -174.26626
   45    39 S   NT   _N4_    59     1.47116   109.58831    61.20071
   46    45 S   H    _H9_    60     1.01842   109.65719   -62.95829
   47    45 S   H    _H10    61     1.01947   109.60424   179.08123
   48    40 S   CM   _C5_    42     1.34303   127.13461   120.28293
   49    48 S   HC   _H5_    43     1.08609   120.21616    -1.06459
   50    48 S   CT   _C4_    44     1.49738   123.77158   178.49442
   51    50 S   HC   _H3_    45     1.09425   111.81472     5.22360
   52    50 S   HC   _H4_    46     1.09418   109.14083   127.62711
   53    50 S   NG   _N5_    47     1.46906   107.65785  -113.93677
   54    53 S   H    _H11    48     1.01740   119.45901     6.70976
   55    53 S   CG   _C10    49     1.38333   123.09392  -172.74988
   56    55 S   NG   _N7_    50     1.38147   119.01300   178.82297
   57    56 S   H    _H14    51     1.01595   121.26108     0.10653
   58    56 S   H    _H15    52     1.01587   121.17196  -179.98022
   59    55 S   NG   _N6_    53     1.37789   122.13135    -1.23765
   60    59 S   H    _H12    54     1.01531   121.24927   179.48718
   61    59 S   H    _H13    55     1.02121   122.27041    -1.35176
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   8   3   2   7   4   7   5   4   3
  12   5   4   2   1   1  11  13   5   6   2   1   3   1   1   7
   4   7   4   3   8   3   6   5   2   1   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    42    45  
   31    32    36    37    38  
   32    36    37    38  
   36    37    38  
   34    35    39    40    41    48    42    43    44    45    46    47  
   35    39    40    42    45  
   39    40    42    45  
   37    38  
   38  
    0  
   40    41    48    49    50    42    43    44    45    46    47  
   41    48    49    50    51    52    53    42    43    44    45    46    47  
   48    49    50    42    45  
   43    44    45    46    47    48  
   44    45  
   45  
   46    47    48  
   47  
    0  
   49    50    51    52    53    54    55  
   50    51    52    53  
   51    52    53    54    55    56    59  
   52    53    54    55  
   53    54    55  
   54    55    56    57    58    59    60    61  
   55    56    59  
   56    57    58    59    60    61  
   57    58    59    60    61  
   58    59  
   59  
   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  -0.063800   1.9750   1.7500   0.005000000  -0.741685710
   34   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   35   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   36   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   37   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   39   3.5000   0.0660   0.411900   1.9750   1.7500   0.005000000  -0.741685710
   40   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   41   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   42   3.7500   0.1050   0.600000   2.1120   1.8750   0.001000000  -0.126889456
   43   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   3.3000   0.1700  -1.020600   1.8650   1.6500   0.051222218  -2.220205820
   46   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   47   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   48   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   49   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.213000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   3.2500   0.1700  -0.528167   2.1120   1.8750   0.051222218  -2.220205820
   54   0.5000   0.0300   0.345100   0.9960   0.8600   0.030040813  -0.651083722
   55   2.2500   0.0500   0.837600   2.1120   1.8750   0.001000000  -0.126889456
   56   3.2500   0.1700  -0.913767   2.1120   1.8750   0.051222218  -2.220205820
   57   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   58   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   59   3.2500   0.1700  -0.913767   2.2900   2.0360   0.003973653   1.685851020
   60   0.5000   0.0300   0.460000   0.9960   0.8600   0.030040813  -0.651083722
   61   0.5000   0.0300   0.460000   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    36   317.000  1.522
   36    37   656.000  1.250
   36    38   656.000  1.250
   24    25   340.000  1.090
   24    26   340.000  1.090
   24    29   222.000  1.810
   29    33   222.000  1.810
   33    34   340.000  1.090
   33    35   340.000  1.090
   33    39   268.000  1.529
   39    40   317.000  1.510
   39    42   317.000  1.522
   39    45   382.000  1.448
   40    41   340.000  1.080
   40    48   549.000  1.340
   48    49   340.000  1.080
   48    50   317.000  1.510
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   337.000  1.463
   53    54   434.000  1.010
   53    55   481.000  1.340
   55    56   481.000  1.340
   55    59   481.000  1.340
   56    57   434.000  1.010
   56    58   434.000  1.010
   59    60   434.000  1.010
   59    61   434.000  1.010
   42    43   656.000  1.250
   42    44   656.000  1.250
   45    46   434.000  1.010
   45    47   434.000  1.010
THET
    1     5     6    35.00000  109.50000
    1     5     7    80.00000  109.26000
    1     5    10    80.00000  111.20000
    3     1     2    35.00000  109.50000
    4     1     2    35.00000  109.50000
    4     1     3    35.00000  109.50000
    5     1     2    35.00000  109.50000
    5     1     3    35.00000  109.50000
    5     1     4    35.00000  109.50000
    5     7     8    70.00000  117.00000
    5     7     9    70.00000  117.00000
    5    10    11    37.50000  110.70000
    5    10    12    37.50000  110.70000
    5    10    13    58.35000  112.70000
    7     5     6    35.00000  109.50000
    9     7     8    80.00000  126.00000
   10     5     6    37.50000  110.70000
   10     5     7    70.00000  109.69300
   10    13    14    37.50000  110.70000
   10    13    15    37.50000  110.70000
   10    13    16    63.00000  111.10000
   12    10    11    33.00000  107.80000
   13    10    11    37.50000  110.70000
   13    10    12    37.50000  110.70000
   13    16    17    80.00000  120.40000
   13    16    18    70.00000  116.60000
   15    13    14    33.00000  107.80000
   16    13    14    35.00000  109.50000
   16    13    15    35.00000  109.50000
   16    18    19    35.00000  119.80000
   16    18    20    50.00000  121.90000
   18    16    17    80.00000  122.90000
   18    20    21    35.00000  109.50000
   18    20    22    63.00000  110.10000
   18    20    24    80.00000  109.70000
   20    18    19    38.00000  118.40000
   20    22    23    80.00000  120.40000
   20    22    27    70.00000  116.60000
   20    24    25    37.50000  110.70000
   20    24    26    37.50000  110.70000
   20    24    29    75.00000  108.68000
   22    20    21    35.00000  109.50000
   22    27    28    35.00000  119.80000
   22    27    30    50.00000  121.90000
   27    22    23    80.00000  122.90000
   27    30    31    35.00000  109.50000
   27    30    32    35.00000  109.50000
   27    30    36    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    36    37    70.00000  117.00000
   30    36    38    70.00000  117.00000
   32    30    31    33.00000  107.80000
   36    30    31    35.00000  109.50000
   36    30    32    35.00000  109.50000
   38    36    37    80.00000  126.00000
   24    20    21    37.50000  110.70000
   24    20    22    63.00000  111.10000
   24    29    33    62.00000   98.90000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    35.00000  109.50000
   29    33    35    35.00000  109.50000
   29    33    39    75.00000  111.63000
   33    39    40    70.00000  112.02700
   33    39    42    70.00000  109.69300
   33    39    45    56.20000  109.47000
   35    33    34    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    35    37.50000  110.70000
   39    40    41    35.00000  117.00000
   39    40    48    70.00000  124.00000
   39    42    43    70.00000  117.00000
   39    42    44    70.00000  117.00000
   39    45    46    35.00000  109.50000
   39    45    47    35.00000  109.50000
   40    48    49    35.00000  120.00000
   40    48    50    70.00000  124.00000
   48    40    41    35.00000  120.00000
   48    50    51    35.00000  109.50000
   48    50    52    35.00000  109.50000
   48    50    53    85.00000  108.88000
   50    48    49    35.00000  117.00000
   50    53    54    35.00000  118.40000
   50    53    55    50.00000  123.20000
   52    50    51    33.00000  107.80000
   53    50    51    35.00000  109.50000
   53    50    52    35.00000  109.50000
   53    55    56    70.00000  120.00000
   53    55    59    70.00000  120.00000
   55    53    54    35.00000  120.00000
   55    56    57    35.00000  120.00000
   55    56    58    35.00000  120.00000
   55    59    60    35.00000  120.00000
   55    59    61    35.00000  120.00000
   58    56    57    35.00000  120.00000
   59    55    56    70.00000  120.00000
   61    59    60    35.00000  120.00000
   42    39    40    65.00000  111.94000
   44    42    43    80.00000  126.00000
   45    39    40    75.00000  110.70900
   45    39    42    80.00000  109.96600
   47    45    46    43.60000  106.40000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33   0.01700  1.0 1.0
   20    24    29    33  -0.23550 -1.0 2.0
   20    24    29    33   0.21350  1.0 3.0
   21    20    22    23   0.00000  1.0 1.0
   21    20    22    27   0.00000  1.0 1.0
   21    20    24    25   0.15000  1.0 3.0
   21    20    24    26   0.15000  1.0 3.0
   21    20    24    29   0.15000  1.0 3.0
   22    20    24    25  -0.03800  1.0 3.0
   22    20    24    26  -0.03800  1.0 3.0
   22    20    24    29  -2.17200  1.0 1.0
   22    20    24    29  -0.85700 -1.0 2.0
   22    27    30    31   0.00000  1.0 1.0
   22    27    30    32   0.00000  1.0 1.0
   22    27    30    36  -0.29800  1.0 1.0
   22    27    30    36   0.13950 -1.0 2.0
   22    27    30    36  -2.45650  1.0 3.0
   23    22    27    28   2.45000 -1.0 2.0
   23    22    27    30   3.04450 -1.0 2.0
   27    30    36    37   0.00000  1.0 1.0
   27    30    36    38   0.00000  1.0 1.0
   28    27    30    31   0.00000  1.0 1.0
   28    27    30    32   0.00000  1.0 1.0
   28    27    30    36   0.00000  1.0 1.0
   31    30    36    37   0.00000  1.0 1.0
   31    30    36    38   0.00000  1.0 1.0
   32    30    36    37   0.00000  1.0 1.0
   32    30    36    38   0.00000  1.0 1.0
   24    20    22    23   0.00000  1.0 1.0
   24    20    22    27   0.93250  1.0 1.0
   24    20    22    27   0.04450 -1.0 2.0
   24    20    22    27   0.17550  1.0 3.0
   24    29    33    34   0.32350  1.0 3.0
   24    29    33    35   0.32350  1.0 3.0
   24    29    33    39   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    39    40   0.56750  1.0 1.0
   29    33    39    40  -0.07550 -1.0 2.0
   29    33    39    40   0.20000  1.0 3.0
   29    33    39    42   0.56750  1.0 1.0
   29    33    39    42  -0.07550 -1.0 2.0
   29    33    39    42   0.20000  1.0 3.0
   29    33    39    45   0.56750  1.0 1.0
   29    33    39    45  -0.07550 -1.0 2.0
   29    33    39    45   0.20000  1.0 3.0
   33    39    40    41   0.00000  1.0 1.0
   33    39    40    48   0.09850  1.0 1.0
   33    39    40    48   0.15250 -1.0 2.0
   33    39    40    48  -0.50650  1.0 3.0
   33    39    42    43   0.41150 -1.0 2.0
   33    39    42    44   0.41150 -1.0 2.0
   33    39    45    46  -0.05950  1.0 1.0
   33    39    45    46   0.08850 -1.0 2.0
   33    39    45    46   0.11750  1.0 3.0
   33    39    45    47  -0.05950  1.0 1.0
   33    39    45    47   0.08850 -1.0 2.0
   33    39    45    47   0.11750  1.0 3.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    42  -0.11250  1.0 3.0
   34    33    39    45   0.15000  1.0 3.0
   35    33    39    40   0.15000  1.0 3.0
   35    33    39    42  -0.11250  1.0 3.0
   35    33    39    45   0.15000  1.0 3.0
   39    40    48    49   7.00000 -1.0 2.0
   39    40    48    50   7.00000 -1.0 2.0
   40    39    42    43   0.30150 -1.0 2.0
   40    39    42    44   0.30150 -1.0 2.0
   40    39    45    46   0.12450  1.0 1.0
   40    39    45    46  -0.40750 -1.0 2.0
   40    39    45    46   0.30300  1.0 3.0
   40    39    45    47   0.12450  1.0 1.0
   40    39    45    47  -0.40750 -1.0 2.0
   40    39    45    47   0.30300  1.0 3.0
   40    48    50    51   0.00000  1.0 1.0
   40    48    50    52   0.00000  1.0 1.0
   40    48    50    53   0.62150  1.0 1.0
   40    48    50    53   0.42850 -1.0 2.0
   40    48    50    53  -0.68200  1.0 3.0
   41    40    48    49   7.00000 -1.0 2.0
   41    40    48    50   7.00000 -1.0 2.0
   48    50    53    54   0.00000  1.0 1.0
   48    50    53    55  -0.12500  1.0 1.0
   48    50    53    55  -0.12500 -1.0 2.0
   48    50    53    55   0.25000  1.0 3.0
   49    48    50    51   0.33100  1.0 3.0
   49    48    50    52   0.33100  1.0 3.0
   49    48    50    53   0.00000  1.0 1.0
   50    53    55    56   3.96800 -1.0 2.0
   50    53    55    59   3.96800 -1.0 2.0
   51    50    53    54   0.00000  1.0 1.0
   51    50    53    55   0.08850  1.0 3.0
   52    50    53    54   0.00000  1.0 1.0
   52    50    53    55   0.08850  1.0 3.0
   53    55    56    57   1.50000 -1.0 2.0
   53    55    56    58   1.50000 -1.0 2.0
   53    55    59    60   1.50000 -1.0 2.0
   53    55    59    61   1.50000 -1.0 2.0
   54    53    55    56   1.50000 -1.0 2.0
   54    53    55    59   1.50000 -1.0 2.0
   56    55    59    60   1.50000 -1.0 2.0
   56    55    59    61   1.50000 -1.0 2.0
   59    55    56    57   1.50000 -1.0 2.0
   59    55    56    58   1.50000 -1.0 2.0
   42    39    40    41   0.00000  1.0 1.0
   42    39    40    48  -0.51250  1.0 1.0
   42    39    40    48  -0.88800 -1.0 2.0
   42    39    40    48   0.08850  1.0 3.0
   42    39    45    46   0.21900  1.0 1.0
   42    39    45    46  -0.24900 -1.0 2.0
   42    39    45    46   0.15200  1.0 3.0
   42    39    45    47   0.21900  1.0 1.0
   42    39    45    47  -0.24900 -1.0 2.0
   42    39    45    47   0.15200  1.0 3.0
   45    39    40    41   0.00000  1.0 1.0
   45    39    40    48   0.90200  1.0 1.0
   45    39    40    48   0.57900 -1.0 2.0
   45    39    40    48  -0.62100  1.0 3.0
   45    39    42    43   0.30150 -1.0 2.0
   45    39    42    44   0.30150 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    36    38  10.50000 -1.0 2.0
   39    41    40    48  15.00000 -1.0 2.0
   50    49    48    40  15.00000 -1.0 2.0
   54    55    53    50   1.00000 -1.0 2.0
   53    56    55    59  10.50000 -1.0 2.0
   58    55    56    57   1.00000 -1.0 2.0
   60    61    59    55   1.00000 -1.0 2.0
   43    39    42    44  10.50000 -1.0 2.0
END
