* LIGAND DATABASE FILE (OPLS2005)
*
001      74    74    133    195     385
    1     0 S   NP   _N1_     1    28.74012    96.49346   -23.64760
    2     1 S   H    _HN1     2     1.02950    73.59939     9.30170
    3     1 S   H    _H1_     3     1.02829    36.19787   166.29668
    4     1 S   H    _H2_     4     1.02785   106.31020   -95.53377
    5     1 S   CT   _CA1     5     1.50113   136.86302   111.85523
    6     5 S   HC   _HA1     6     1.09572   105.19989    90.15578
    7     5 S   CO3  _C1_     7     1.53793   112.45767   -30.09016
    8     7 S   O2Z  _O11     8     1.26373   115.00720   -42.48500
    9     7 S   O2Z  _O12     9     1.26240   114.94879   136.64997
   10     5 S   CT   _CB1    10     1.53078   107.42241  -151.84837
   11    10 S   HC   HB11    11     1.09832   109.39083   -49.61318
   12    10 S   HC   HB12    12     1.09814   110.43692    66.99915
   13    10 S   CT   _CG1    13     1.52990   112.60391  -170.59065
   14    13 S   HC   HG11    14     1.09582   110.61806   -65.25704
   15    13 S   HC   HG12    15     1.09668   109.80470    53.98031
   16    13 S   C    _CD1    16     1.51795   112.23390   174.44155
   17    16 S   O    _OE1    17     1.22729   123.28114     6.21722
   18    16 S   N    _N2_    18     1.38658   111.66443  -173.89857
   19    18 S   H    _HN2    19     1.01576   118.94518     1.85857
   20    18 S   CT1  _CA2    20     1.46199   123.37609   177.88104
   21    20 S   HC   _HA2    21     1.09739   109.37835     2.19044
   22    20 S   C    _C2_    22     1.53549   108.51877  -113.29473
   23    22 S   O    _O2_    23     1.23057   122.31475  -147.15866
   24    20 S   CT   _CB2    32     1.53463   111.70369   124.17546
   25    24 S   HC   HB21    33     1.09521   109.70557    56.44028
   26    24 S   HC   HB22    34     1.09362   109.69428   175.09001
   27    22 S   N    _N3_    24     1.38338   113.67205    40.20765
   28    27 S   H    _HN3    25     1.01589   119.58308    -3.21534
   29    24 S   S    _SG2    35     1.83096   111.19044   -63.72802
   30    27 S   CT   _CA3    26     1.45287   123.19888   177.15325
   31    30 S   HC   HA31    27     1.09549   107.49642   -64.82141
   32    30 S   HC   HA32    28     1.09557   107.99535    51.61136
   33    29 S   CT   _C13    36     1.85793   102.19152  -161.68008
   34    30 S   CO3  _C3_    29     1.52957   114.09704   173.61709
   35    34 S   O2Z  _O31    30     1.26374   116.07585    -0.81733
   36    34 S   O2Z  _O32    31     1.26431   114.41035   179.24931
   37    33 S   CO4  _C7_    37     1.53394   110.11707    61.55334
   38    37 S   O    _O18    38     1.23044   123.80502    27.30600
   39    33 S   CT   _C17    48     1.56044   108.26114  -179.00909
   40    39 S   HC   _H35    49     1.09876   109.34051   179.25218
   41    39 S   HC   _H36    50     1.09568   109.59785    65.34653
   42    37 S   CM   _C5_    39     1.48565   117.94586  -156.79072
   43    42 S   HC   _H21    40     1.08460   117.02464  -168.59651
   44    39 S   CM   _C8_    51     1.50985   115.98649   -61.50058
   45    44 S   HC   _H22    52     1.08971   114.18452   -68.66823
   46    42 S   CM   _C4_    41     1.33430   122.05800     9.81426
   47    46 S   HC   _H20    42     1.08405   121.28966  -177.59320
   48    44 S   CM   _C10    53     1.34795   128.19501   113.59726
   49    46 S   CO4  _C6_    43     1.47923   121.20164     3.76676
   50    49 S   O    _O17    44     1.22864   119.87884  -172.68530
   51    48 S   CT   _C14    54     1.50433   124.97065    -2.94763
   52    51 S   HC   _H26    55     1.09384   110.51809   113.69042
   53    51 S   HC   _H27    56     1.09538   110.06357  -126.74829
   54    51 S   HC   _H28    57     1.09179   113.57797    -7.30366
   55    48 S   CT   _C19    58     1.51863   119.87764   178.91773
   56    55 S   HC   _H39    59     1.09771   108.57813   132.13061
   57    55 S   HC   _H40    60     1.09842   110.55722    17.12998
   58    33 S   CT   _C12    45     1.53761   109.28201   -59.81134
   59    58 S   HC   _H24    46     1.09536   112.52621    51.84369
   60    58 S   HC   _H25    47     1.09694   110.67960   -68.87548
   61    55 S   CT   _C18    61     1.53474   113.80679  -106.34492
   62    61 S   HC   _H37    62     1.09321   110.49867   -57.32991
   63    61 S   HC   _H38    63     1.09762   108.29554  -172.31272
   64    61 S   CM   _C9_    64     1.50485   112.41752    69.32988
   65    64 S   HC   _H23    65     1.08979   113.84775    67.69893
   66    64 S   CM   _C11    66     1.34663   128.24073  -112.57103
   67    66 S   CT   _C15    67     1.50605   120.33261  -179.83449
   68    67 S   HC   _H29    68     1.09496   110.23780   120.49968
   69    67 S   HC   _H30    69     1.09511   112.44273     0.40007
   70    67 S   HC   _H31    70     1.09500   110.23639  -119.68351
   71    66 S   CT   _C16    71     1.50226   125.44674     0.77984
   72    71 S   HC   _H32    72     1.09526   110.00265   120.63433
   73    71 S   HC   _H33    73     1.09510   110.04630  -120.11730
   74    71 S   HC   _H34    74     1.09118   113.73892     0.39958
  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  12   5   4   3
  16   2   1   1  13   5  12   5   4   6   3  11   3   6   3  11
   4   3   7   3   2   1   8   5   4   2   1   1   7   4   3  10
   3   8   7   3   2   1   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    58    39    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    42    49    58    59    60    39    40    41    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    42    43    46    49    50    58    59    60    39    40    41    44    45    48  
   35    36  
   36  
    0  
   38    42    43    46    47    49    58    59    60    39    40    41    44  
   42    43    46    58    39  
   40    41    44    45    48    51    55    42    49    58    59    60  
   41    44    45    48    58  
   44    45    48    58  
   43    46    47    49    50    58  
   46    47    49  
   45    48    51    52    53    54    55    56    57    61    58  
   48    51    55  
   47    49    50    58    59    60  
   49    50    58  
   51    52    53    54    55    56    57    61    62    63    64  
   50    58    59    60  
   58    59    60  
   52    53    54    55    56    57    61  
   53    54    55  
   54    55  
   55  
   56    57    61    62    63    64    65    66  
   57    61    62    63    64  
   61    62    63    64  
   59    60  
   60  
    0  
   62    63    64    65    66    67    71  
   63    64    65    66  
   64    65    66  
   65    66    67    68    69    70    71    72    73    74  
   66    67    71  
   67    68    69    70    71    72    73    74  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71  
   71  
   72    73    74  
   73    74  
   74  
    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   0.167500   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   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   42   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   43   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   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   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   47   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   48   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   49   3.7500   0.1050   0.470000   2.1120   1.8750   0.001000000  -0.126889456
   50   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   51   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   59   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   2.4200   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   62   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   65   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   66   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   67   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   69   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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    58   268.000  1.529
   33    39   268.000  1.529
   37    38   570.000  1.229
   37    42   320.000  1.462
   42    43   340.000  1.080
   42    46   549.000  1.340
   46    47   340.000  1.080
   46    49   320.000  1.462
   49    50   570.000  1.229
   49    58   317.000  1.522
   58    59   340.000  1.090
   58    60   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   317.000  1.510
   44    45   340.000  1.080
   44    48   549.000  1.340
   48    51   317.000  1.510
   48    55   317.000  1.510
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   340.000  1.090
   55    56   340.000  1.090
   55    57   340.000  1.090
   55    61   268.000  1.529
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   317.000  1.510
   64    65   340.000  1.080
   64    66   549.000  1.340
   66    67   317.000  1.510
   66    71   317.000  1.510
   67    68   340.000  1.090
   67    69   340.000  1.090
   67    70   340.000  1.090
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   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    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    75.00000  110.18000
   29    33    58    75.00000  111.63000
   29    33    39    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    42    65.00000  118.62400
   33    58    49    63.00000  111.10000
   33    58    59    37.50000  110.70000
   33    58    60    37.50000  110.70000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    44    70.00000  112.02700
   37    42    43    40.00000  117.72500
   37    42    46    65.00000  118.96000
   42    37    38    80.00000  123.72100
   42    46    47    35.00000  120.00000
   42    46    49    65.00000  118.96000
   46    42    43    35.00000  120.00000
   46    49    50    80.00000  123.72100
   46    49    58    65.00000  118.62400
   49    46    47    40.00000  117.72500
   49    58    59    35.00000  109.50000
   49    58    60    35.00000  109.50000
   58    33    37    63.00000  111.10000
   58    49    50    80.00000  120.40000
   60    58    59    33.00000  107.80000
   39    33    37    63.00000  111.10000
   39    33    58    58.35000  112.70000
   39    44    45    35.00000  117.00000
   39    44    48    70.00000  124.00000
   41    39    40    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    41    35.00000  109.50000
   44    48    51    70.00000  124.00000
   44    48    55    70.00000  124.00000
   48    44    45    35.00000  120.00000
   48    51    52    35.00000  109.50000
   48    51    53    35.00000  109.50000
   48    51    54    35.00000  109.50000
   48    55    56    35.00000  109.50000
   48    55    57    35.00000  109.50000
   48    55    61    70.00000  112.02700
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    33.00000  107.80000
   55    48    51    65.00000  117.92700
   55    61    62    37.50000  110.70000
   55    61    63    37.50000  110.70000
   55    61    64    70.00000  112.02700
   57    55    56    33.00000  107.80000
   61    55    56    37.50000  110.70000
   61    55    57    37.50000  110.70000
   61    64    65    35.00000  117.00000
   61    64    66    70.00000  124.00000
   63    61    62    33.00000  107.80000
   64    61    62    35.00000  109.50000
   64    61    63    35.00000  109.50000
   64    66    67    70.00000  124.00000
   64    66    71    70.00000  124.00000
   66    64    65    35.00000  120.00000
   66    67    68    35.00000  109.50000
   66    67    69    35.00000  109.50000
   66    67    70    35.00000  109.50000
   66    71    72    35.00000  109.50000
   66    71    73    35.00000  109.50000
   66    71    74    35.00000  109.50000
   69    67    68    33.00000  107.80000
   70    67    68    33.00000  107.80000
   70    67    69    33.00000  107.80000
   71    66    67    65.00000  117.92700
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    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    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    58   0.01700  1.0 1.0
   24    29    33    58  -0.23550 -1.0 2.0
   24    29    33    58   0.21350  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    37    38   0.30150 -1.0 2.0
   29    33    37    42   0.65300  1.0 1.0
   29    33    37    42  -0.03850 -1.0 2.0
   29    33    37    42   0.33900  1.0 3.0
   29    33    58    49   0.56750  1.0 1.0
   29    33    58    49  -0.07550 -1.0 2.0
   29    33    58    49   0.20000  1.0 3.0
   29    33    58    59   0.15000  1.0 3.0
   29    33    58    60   0.15000  1.0 3.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    37    42    43   0.04550  1.0 1.0
   33    37    42    43   0.83000 -1.0 2.0
   33    37    42    43  -0.04000  1.0 3.0
   33    37    42    46  -0.33500  1.0 1.0
   33    37    42    46   1.06600 -1.0 2.0
   33    37    42    46  -0.14000  1.0 3.0
   33    39    44    45   0.00000  1.0 1.0
   33    39    44    48   0.09850  1.0 1.0
   33    39    44    48   0.15250 -1.0 2.0
   33    39    44    48  -0.50650  1.0 3.0
   37    33    58    49   0.11950  1.0 1.0
   37    33    58    49   0.20300 -1.0 2.0
   37    33    58    49  -0.70800  1.0 3.0
   37    33    58    59  -0.11250  1.0 3.0
   37    33    58    60  -0.11250  1.0 3.0
   37    33    39    40  -0.11250  1.0 3.0
   37    33    39    41  -0.11250  1.0 3.0
   37    33    39    44  -0.98800  1.0 1.0
   37    33    39    44   0.48800 -1.0 2.0
   37    33    39    44   0.76800  1.0 3.0
   37    42    46    47   7.00000 -1.0 2.0
   37    42   -46    49   7.00000 -1.0 2.0
   38    37    42    43   0.00000  1.0 1.0
   38    37    42    46   1.00000 -1.0 2.0
   42    46    49    50   1.00000 -1.0 2.0
   42    46    49    58  -0.33500  1.0 1.0
   42    46    49    58   1.06600 -1.0 2.0
   42    46    49    58  -0.14000  1.0 3.0
   43    42    46    47   7.00000 -1.0 2.0
   43    42    46    49   7.00000 -1.0 2.0
   46    49   -58    33   0.65300  1.0 1.0
   46    49   -58    33  -0.03850 -1.0 2.0
   46    49   -58    33   0.33900  1.0 3.0
   46    49    58    59   0.00000  1.0 1.0
   46    49    58    60   0.00000  1.0 1.0
   47    46    49    50   0.00000  1.0 1.0
   47    46    49    58   0.04550  1.0 1.0
   47    46    49    58   0.83000 -1.0 2.0
   47    46    49    58  -0.04000  1.0 3.0
   50    49    58    33   0.30150 -1.0 2.0
   50    49    58    59   0.00000  1.0 1.0
   50    49    58    60   0.00000  1.0 1.0
   58    33    37    38   0.30150 -1.0 2.0
   58    33   -37    42   0.65300  1.0 1.0
   58    33   -37    42  -0.03850 -1.0 2.0
   58    33   -37    42   0.33900  1.0 3.0
   58    33    39    40   0.15000  1.0 3.0
   58    33    39    41   0.15000  1.0 3.0
   58    33    39    44   0.34400  1.0 1.0
   58    33    39    44   0.09450 -1.0 2.0
   58    33    39    44   0.11100  1.0 3.0
   39    33    37    38   0.30150 -1.0 2.0
   39    33    37    42   0.65300  1.0 1.0
   39    33    37    42  -0.03850 -1.0 2.0
   39    33    37    42   0.33900  1.0 3.0
   39    33    58    49  -0.95700  1.0 1.0
   39    33    58    49  -0.18200 -1.0 2.0
   39    33    58    49   0.29450  1.0 3.0
   39    33    58    59   0.15000  1.0 3.0
   39    33    58    60   0.15000  1.0 3.0
   39    44    48    51   7.00000 -1.0 2.0
   39    44    48    55   7.00000 -1.0 2.0
   40    39    44    45   0.33100  1.0 3.0
   40    39    44    48   0.00000  1.0 1.0
   41    39    44    45   0.33100  1.0 3.0
   41    39    44    48   0.00000  1.0 1.0
   44    48    51    52   0.00000  1.0 1.0
   44    48    51    53   0.00000  1.0 1.0
   44    48    51    54   0.00000  1.0 1.0
   44    48    55    56   0.00000  1.0 1.0
   44    48    55    57   0.00000  1.0 1.0
   44    48    55    61   0.09850  1.0 1.0
   44    48    55    61   0.15250 -1.0 2.0
   44    48    55    61  -0.50650  1.0 3.0
   45    44    48    51   7.00000 -1.0 2.0
   45    44    48    55   7.00000 -1.0 2.0
   48    55    61    62   0.15000  1.0 3.0
   48    55    61    63   0.15000  1.0 3.0
   48    55    61    64   0.31000  1.0 1.0
   48    55    61    64   0.14700 -1.0 2.0
   48    55    61    64   0.07550  1.0 3.0
   51    48    55    56   0.34800  1.0 3.0
   51    48    55    57   0.34800  1.0 3.0
   51    48    55    61   0.46850  1.0 1.0
   51    48    55    61   0.08550 -1.0 2.0
   51    48    55    61   0.09800  1.0 3.0
   55    48    51    52   0.34800  1.0 3.0
   55    48    51    53   0.34800  1.0 3.0
   55    48    51    54   0.34800  1.0 3.0
   55    61    64    65   0.00000  1.0 1.0
   55    61    64    66   0.09850  1.0 1.0
   55    61    64    66   0.15250 -1.0 2.0
   55    61    64    66  -0.50650  1.0 3.0
   56    55    61    62   0.15000  1.0 3.0
   56    55    61    63   0.15000  1.0 3.0
   56    55    61    64   0.15000  1.0 3.0
   57    55    61    62   0.15000  1.0 3.0
   57    55    61    63   0.15000  1.0 3.0
   57    55    61    64   0.15000  1.0 3.0
   61    64    66    67   7.00000 -1.0 2.0
   61    64    66    71   7.00000 -1.0 2.0
   62    61    64    65   0.33100  1.0 3.0
   62    61    64    66   0.00000  1.0 1.0
   63    61    64    65   0.33100  1.0 3.0
   63    61    64    66   0.00000  1.0 1.0
   64    66    67    68   0.00000  1.0 1.0
   64    66    67    69   0.00000  1.0 1.0
   64    66    67    70   0.00000  1.0 1.0
   64    66    71    72   0.00000  1.0 1.0
   64    66    71    73   0.00000  1.0 1.0
   64    66    71    74   0.00000  1.0 1.0
   65    64    66    67   7.00000 -1.0 2.0
   65    64    66    71   7.00000 -1.0 2.0
   67    66    71    72   0.34800  1.0 3.0
   67    66    71    73   0.34800  1.0 3.0
   67    66    71    74   0.34800  1.0 3.0
   71    66    67    68   0.34800  1.0 3.0
   71    66    67    69   0.34800  1.0 3.0
   71    66    67    70   0.34800  1.0 3.0
IPHI
    9     5     7     8  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    34    35  10.50000 -1.0 2.0
   33    42    37    38  10.50000 -1.0 2.0
   37    43    42    46   1.10000 -1.0 2.0
   49    47    46    42   1.10000 -1.0 2.0
   46    58    49    50  10.50000 -1.0 2.0
   39    45    44    48  15.00000 -1.0 2.0
   51    55    48    44  15.00000 -1.0 2.0
   61    65    64    66  15.00000 -1.0 2.0
   67    71    66    64  15.00000 -1.0 2.0
END
