* LIGAND DATABASE FILE (OPLS2005)
*
001      73    74    129    187     364
    1     0 S   NP   _N1_     1    30.99977    92.28353   -27.16396
    2     1 S   H    _HN1     2     1.02941   111.01471   -22.62189
    3     1 S   H    _H1_     3     1.02820     5.48969   -67.49076
    4     1 S   H    _H2_     4     1.02810   109.43059  -142.17873
    5     1 S   CT   _CA1     5     1.50097   105.47174    97.01265
    6     5 S   HC   _HA1     6     1.09558   105.21714    57.56355
    7     5 S   CO3  _C1_     7     1.53817   112.60979   -62.88459
    8     7 S   O2Z  _O11     8     1.26388   115.02468   -39.53994
    9     7 S   O2Z  _O12     9     1.26235   115.00196   139.75212
   10     5 S   CT   _CB1    10     1.53024   107.42139   175.80633
   11    10 S   HC   HB11    11     1.09849   109.67924   -47.45213
   12    10 S   HC   HB12    12     1.09727   110.25603    69.01309
   13    10 S   CT   _CG1    13     1.53000   112.58178  -168.14911
   14    13 S   HC   HG11    14     1.09487   111.17915   -63.42156
   15    13 S   HC   HG12    15     1.09638   109.43040    55.67280
   16    13 S   C    _CD1    16     1.51682   111.55112   176.82578
   17    16 S   O    _OE1    17     1.22781   122.99566    24.93683
   18    16 S   N    _N2_    18     1.38600   112.19045  -155.61821
   19    18 S   H    _HN2    19     1.01556   119.16436     2.45272
   20    18 S   CT1  _CA2    20     1.46054   123.16794   177.72213
   21    20 S   HC   _HA2    21     1.09627   109.09989    12.51380
   22    20 S   C    _C2_    22     1.53779   109.60994  -102.98732
   23    22 S   O    _O2_    23     1.23107   121.97090  -151.74266
   24    20 S   CT   _CB2    32     1.53333   111.68095   134.56363
   25    24 S   HC   HB21    33     1.09656   109.71652    65.12994
   26    24 S   HC   HB22    34     1.09581   110.70223  -177.62958
   27    22 S   N    _N3_    24     1.38211   114.14697    35.60659
   28    27 S   H    _HN3    25     1.01496   119.69589    -2.91276
   29    24 S   S    _SG2    35     1.82770   114.94938   -54.87799
   30    27 S   CT   _CA3    26     1.45284   123.44922   177.42109
   31    30 S   HC   HA31    27     1.09543   107.49879   -65.64720
   32    30 S   HC   HA32    28     1.09550   108.05191    50.87005
   33    29 S   CT   _C18    36     1.81828    99.95460   -60.85226
   34    33 S   HC   _H16    37     1.08782   109.93011    71.90330
   35    33 S   HC   _H17    38     1.09519   109.86918   -46.61897
   36    30 S   CO3  _C3_    29     1.53024   113.91259   172.86991
   37    36 S   O2Z  _O31    30     1.26406   116.06254    -0.67086
   38    36 S   O2Z  _O32    31     1.26415   114.43433   179.39026
   39    33 S   C    _C17    39     1.52078   108.08574  -163.71823
   40    39 S   O    _O34    40     1.23686   118.63778    80.58167
   41    39 S   N    _N4_    41     1.39943   118.60356   -97.03888
   42    41 S   CA   _C10    42     1.42792   123.64928    -6.44975
   43    41 S   CT   _C11    59     1.47540   119.71105   173.07479
   44    43 S   HC   _H9_    60     1.09662   109.42028   -23.01103
   45    43 S   HC   _H10    61     1.09499   110.01949  -139.12354
   46    42 S   CA   _C5_    43     1.41493   119.73222   106.93555
   47    43 S   C5A  _C12    62     1.50240   110.96037    98.94661
   48    46 S   CA   _C6_    44     1.40327   119.20184   175.35059
   49    48 S   HA   _H6_    45     1.08814   120.29729  -179.01543
   50    46 S   CT   _C4_    55     1.50509   123.31504    -3.53142
   51    50 S   HC   _H3_    56     1.09338   112.19806   -25.27450
   52    50 S   HC   _H4_    57     1.09428   110.03416    96.17521
   53    50 S   HC   _H5_    58     1.09578   110.46990  -143.91901
   54    47 S   C5B  _C13    63     1.38355   128.34368    92.96627
   55    48 S   CA   _C7_    46     1.39050   120.86058     1.31522
   56    55 S   HA   _H7_    47     1.08620   119.97214   179.92087
   57    54 S   C5B  _C14    64     1.42788   112.13189   179.86583
   58    57 S   HA   _H11    65     1.08221   125.70443   179.96044
   59    54 S   OS   _O33    69     1.35932   119.25565    -0.10087
   60    55 S   CA   _C8_    48     1.39074   119.92736     0.13848
   61    60 S   HA   _H8_    49     1.08782   118.87156  -179.94405
   62    57 S   C5A  _C15    66     1.37687   112.05828    -0.18975
   63    62 S   HA   _H12    67     1.08096   127.54627  -179.95154
   64    59 S   CT   _C16    70     1.42089   114.81536  -170.99540
   65    64 S   HC   _H13    71     1.09430   107.79925   176.26813
   66    64 S   HC   _H14    72     1.09551   111.27459    58.36974
   67    64 S   HC   _H15    73     1.09506   111.08728   -65.90606
   68    42 S   CA   _C9_    50     1.41566   120.24833   -75.40020
   69    47 S   SA   _S1_    68     1.71541   120.14941   -87.77703
   70    68 S   CT   _C19    51     1.50528   123.99996     0.79770
   71    70 S   HC   _H18    52     1.09455   109.86826  -104.90817
   72    70 S   HC   _H19    53     1.09150   113.29608    16.21710
   73    70 S   HC   _H20    54     1.09574   110.00909   135.46489
  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  13  19  10   4   3  11   8  10
   4   5   2   1   1  10   5   3   6   4   6   6   2   2   1   3
   2   1   1   4   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    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    46    68    43    44    45    47  
   41    42    43  
   42    46    48    60    68    70    50    43    44    45    47    54    69  
   46    48    49    55    60    61    68    70    71    72    73    50    51    52    53    43    44    45    47  
   44    45    47    54    57    62    69    59    46    68  
   45    47    54    69  
   47    54    69  
   48    49    55    56    60    68    70    50    51    52    53  
   54    57    58    62    63    69    59    64  
   49    55    56    60    61    68    50    51    52    53  
   55    56    60    50  
   51    52    53    55    68  
   52    53  
   53  
    0  
   57    58    62    63    69    59    64    65    66    67  
   56    60    61    68    70  
   60    61    68  
   58    62    63    69    59    64  
   62    63    69    59  
   64    65    66    67    62    69  
   61    68    70    71    72    73  
   68    70  
   63    69  
   69  
   65    66    67  
   66    67  
   67  
    0  
   70    71    72    73  
    0  
   71    72    73  
   72    73  
   73  
    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   0.047500   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   3.7500   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   0.065000   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   47   3.5500   0.0700  -0.178700   2.0020   1.7750   0.001000000  -0.843144165
   48   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   49   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   50   3.5000   0.0660  -0.065000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   3.5500   0.0700   0.147300   2.5000   1.7750   0.001000000  -0.843144165
   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   3.5500   0.0700  -0.073800   2.0020   1.7750   0.001000000  -0.843144165
   58   2.4200   0.0300   0.121100   1.3810   1.2100   0.030040813   0.268726247
   59   2.9000   0.1400  -0.300000   1.7660   1.5600   0.020110767  -0.896042159
   60   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   61   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   62   3.5500   0.0700  -0.325500   2.0020   1.7750   0.001000000  -0.843144165
   63   2.4200   0.0300   0.261800   1.3810   1.2100   0.030040813   0.268726247
   64   3.5000   0.0660   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   66   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   69   3.5600   0.3950   0.032800   2.0080   1.7800   0.025682759  -1.666211680
   70   3.5000   0.0660  -0.065000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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
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   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    46   469.000  1.400
   42    68   469.000  1.400
   46    48   469.000  1.400
   46    50   317.000  1.510
   48    49   367.000  1.080
   48    55   469.000  1.400
   55    56   367.000  1.080
   55    60   469.000  1.400
   60    61   367.000  1.080
   60    68   469.000  1.400
   68    70   317.000  1.510
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    73   340.000  1.090
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   43    44   340.000  1.090
   43    45   340.000  1.090
   43    47   295.000  1.489
   47    54   520.000  1.370
   47    69   265.000  1.745
   54    57   400.000  1.425
   54    59   480.000  1.345
   57    58   367.000  1.080
   57    62   520.000  1.370
   62    63   367.000  1.080
   62    69   265.000  1.745
   59    64   320.000  1.410
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   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    35.00000  109.50000
   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    33.00000  107.80000
   39    33    34    35.00000  109.50000
   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    46    70.00000  119.01900
   41    42    68    70.00000  119.01900
   41    43    44    35.00000  109.50000
   41    43    45    35.00000  109.50000
   41    43    47    80.00000  111.96000
   42    46    48    63.00000  120.00000
   42    46    50    70.00000  120.00000
   42    68    60    63.00000  120.00000
   42    68    70    70.00000  120.00000
   46    48    49    35.00000  120.00000
   46    48    55    63.00000  120.00000
   46    50    51    35.00000  109.50000
   46    50    52    35.00000  109.50000
   46    50    53    35.00000  109.50000
   48    55    56    35.00000  120.00000
   48    55    60    63.00000  120.00000
   55    48    49    35.00000  120.00000
   55    60    61    35.00000  120.00000
   55    60    68    63.00000  120.00000
   60    55    56    35.00000  120.00000
   60    68    70    70.00000  120.00000
   68    42    46    63.00000  120.00000
   68    60    61    35.00000  120.00000
   68    70    71    35.00000  109.50000
   68    70    72    35.00000  109.50000
   68    70    73    35.00000  109.50000
   72    70    71    33.00000  107.80000
   73    70    71    33.00000  107.80000
   73    70    72    33.00000  107.80000
   50    46    48    70.00000  120.00000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   43    41    42    70.00000  121.06000
   43    47    54    55.00000  130.44200
   43    47    69    65.00000  123.52500
   45    43    44    33.00000  107.80000
   47    43    44    45.00000  110.47400
   47    43    45    45.00000  110.47400
   47    54    57    75.00000  112.39000
   47    54    59    75.00000  125.18600
   47    69    62   110.00000   90.41100
   54    57    58    35.00000  125.69000
   54    57    62    75.00000  112.39000
   54    59    64    90.00000  112.30700
   57    62    63    35.00000  130.70000
   57    62    69    80.00000  111.29200
   62    57    58    35.00000  128.20000
   69    47    54    80.00000  111.29200
   69    62    63    40.00000  122.38200
   59    54    57    80.00000  117.00000
   59    64    65    35.00000  109.50000
   59    64    66    35.00000  109.50000
   59    64    67    35.00000  109.50000
   66    64    65    33.00000  107.80000
   67    64    65    33.00000  107.80000
   67    64    66    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   0.32350  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   0.30150 -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   0.00000  1.0 1.0
   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    46   1.00100  1.0 1.0
   39    41    42    46   0.85050 -1.0 2.0
   39    41    42    68   1.00100  1.0 1.0
   39    41    42    68   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    47  -0.69800  1.0 1.0
   39    41    43    47  -0.21350 -1.0 2.0
   40    39    41    42   0.04000 -1.0 2.0
   40    39    41    43   3.04450 -1.0 2.0
   41    42    46    48   3.62500 -1.0 2.0
   41    42    46    50   3.62500 -1.0 2.0
   41    42    68    60   3.62500 -1.0 2.0
   41    42    68    70   3.62500 -1.0 2.0
   41    43    47    54  -0.24500  1.0 1.0
   41    43    47    54   0.48300 -1.0 2.0
   41    43    47    54   0.08900  1.0 3.0
   41    43    47    69   0.04300 -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    47   0.17850 -1.0 2.0
   42    46    48    49   3.62500 -1.0 2.0
   42    46    48    55   3.62500 -1.0 2.0
   42    46    50    51   0.00000  1.0 1.0
   42    46    50    52   0.00000  1.0 1.0
   42    46    50    53   0.00000  1.0 1.0
   42    68    70    71   0.00000  1.0 1.0
   42    68    70    72   0.00000  1.0 1.0
   42    68    70    73   0.00000  1.0 1.0
   46    42    68    60   3.62500 -1.0 2.0
   46    42    68    70   3.62500 -1.0 2.0
   46    48    55    56   3.62500 -1.0 2.0
   46    48   -55    60   3.62500 -1.0 2.0
   48    46    50    51   0.00000  1.0 1.0
   48    46    50    52   0.00000  1.0 1.0
   48    46    50    53   0.00000  1.0 1.0
   48    55    60    61   3.62500 -1.0 2.0
   48    55    60    68   3.62500 -1.0 2.0
   49    48    55    56   3.62500 -1.0 2.0
   49    48    55    60   3.62500 -1.0 2.0
   55    60   -68    42   3.62500 -1.0 2.0
   55    60    68    70   3.62500 -1.0 2.0
   56    55    60    61   3.62500 -1.0 2.0
   56    55    60    68   3.62500 -1.0 2.0
   60    68    70    71   0.00000  1.0 1.0
   60    68    70    72   0.00000  1.0 1.0
   60    68    70    73   0.00000  1.0 1.0
   61    60    68    42   3.62500 -1.0 2.0
   61    60    68    70   3.62500 -1.0 2.0
   68    42   -46    48   3.62500 -1.0 2.0
   68    42    46    50   3.62500 -1.0 2.0
   50    46    48    49   3.62500 -1.0 2.0
   50    46    48    55   3.62500 -1.0 2.0
   43    41    42    46   0.81400  1.0 1.0
   43    41    42    46   1.55550 -1.0 2.0
   43    41    42    68   0.81400  1.0 1.0
   43    41    42    68   1.55550 -1.0 2.0
   43    47    54    57   3.62500 -1.0 2.0
   43    47    54    59   3.62500 -1.0 2.0
   43    47    69    62   3.62500 -1.0 2.0
   44    43    47    54   0.00000  1.0 1.0
   44    43    47    69   0.00000  1.0 1.0
   45    43    47    54   0.00000  1.0 1.0
   45    43    47    69   0.00000  1.0 1.0
   47    54    57    58   3.62500 -1.0 2.0
   47    54   -57    62   3.62500 -1.0 2.0
   47    54    59    64   1.63200 -1.0 2.0
   54    47   -69    62   3.62500 -1.0 2.0
   54    57    62    63   3.62500 -1.0 2.0
   54    57   -62    69   3.62500 -1.0 2.0
   54    59    64    65   0.08050  1.0 3.0
   54    59    64    66   0.08050  1.0 3.0
   54    59    64    67   0.08050  1.0 3.0
   57    54    59    64   1.63200 -1.0 2.0
   57    62   -69    47   3.62500 -1.0 2.0
   58    57    62    63   3.62500 -1.0 2.0
   58    57    62    69   3.62500 -1.0 2.0
   63    62    69    47   3.62500 -1.0 2.0
   69    47   -54    57   3.62500 -1.0 2.0
   69    47    54    59   3.62500 -1.0 2.0
   59    54    57    58   3.62500 -1.0 2.0
   59    54    57    62   3.62500 -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
   46    68    42    41   4.00000 -1.0 2.0
   48    50    46    42   4.00000 -1.0 2.0
   55    49    48    46   1.10000 -1.0 2.0
   60    56    55    48   1.10000 -1.0 2.0
   68    61    60    55   1.10000 -1.0 2.0
   60    70    68    42   4.00000 -1.0 2.0
   54    69    47    43   4.00000 -1.0 2.0
   57    59    54    47   4.00000 -1.0 2.0
   62    58    57    54   1.10000 -1.0 2.0
   69    63    62    57   1.10000 -1.0 2.0
END
