* LIGAND DATABASE FILE (OPLS2005)
*
001      74    75    143    221     424
    1     0 S   NP   _N1_     1    28.74797    95.24039   -20.91197
    2     1 S   H    _HN1     2     1.02795    87.48644   -65.97883
    3     1 S   H    _H1_     3     1.02959    89.90445    42.23050
    4     1 S   H    _H2_     4     1.02846    33.06717   165.11557
    5     1 S   CT   _CA1     5     1.50065   143.85969   168.63986
    6     5 S   HC   _HA1     6     1.09587   105.27337    57.34571
    7     5 S   CO3  _C1_     7     1.53679   112.23292   -62.75723
    8     7 S   O2Z  _O11     8     1.26321   115.16834   -52.40916
    9     7 S   O2Z  _O12     9     1.26252   114.96692   127.11286
   10     5 S   CT   _CB1    10     1.53116   107.40657   174.95228
   11    10 S   HC   HB11    11     1.09820   109.13979   -53.27111
   12    10 S   HC   HB12    12     1.09822   110.54387    63.17301
   13    10 S   CT   _CG1    13     1.53021   112.70352  -174.50371
   14    13 S   HC   HG11    14     1.09586   110.32674   -63.88536
   15    13 S   HC   HG12    15     1.09642   110.10617    55.26136
   16    13 S   C    _CD1    16     1.51837   112.22373   175.34305
   17    16 S   O    _OE1    17     1.22726   123.18240    -8.97292
   18    16 S   N    _N2_    18     1.38618   111.73663   171.85158
   19    18 S   H    _HN2    19     1.01567   119.06259     0.44191
   20    18 S   CT1  _CA2    20     1.46257   123.34924   179.38420
   21    20 S   HC   _HA2    21     1.09741   109.33100   -14.02350
   22    20 S   C    _C2_    22     1.53451   108.03614  -129.52053
   23    22 S   O    _O2_    23     1.23001   122.31738  -144.49748
   24    20 S   CT   _CB2    32     1.53472   111.71909   108.21739
   25    24 S   HC   HB21    33     1.09585   109.87292    54.32020
   26    24 S   HC   HB22    34     1.09437   110.05779   173.34404
   27    22 S   N    _N3_    24     1.38532   113.29630    42.72184
   28    27 S   H    _HN3    25     1.01528   118.93110    -0.39860
   29    24 S   S    _SG2    35     1.82742   111.78407   -66.83011
   30    27 S   CT   _CA3    26     1.45457   123.46219   175.16268
   31    30 S   HC   HA31    27     1.09520   109.26846    23.76099
   32    30 S   HC   HA32    28     1.09495   107.11145   140.77731
   33    29 S   CT   _C6_    36     1.84095   100.01751   168.80775
   34    33 S   HC   _H4_    37     1.09646   106.69235   -43.92063
   35    30 S   CO3  _C3_    29     1.52927   113.10113   -99.73456
   36    35 S   O2Z  _O31    30     1.26404   115.40311   -44.24238
   37    35 S   O2Z  _O32    31     1.26354   114.98196   136.68713
   38    33 S   CT   _C7_    38     1.52884   110.09003    72.96374
   39    38 S   HC   _H10    39     1.09506   112.34824    55.97421
   40    38 S   HC   _H11    40     1.09486   111.44038   -65.19717
   41    38 S   HC   _H12    41     1.09567   110.40288   176.31013
   42    33 S   CT   _C5_    42     1.55020   111.99736  -161.74491
   43    42 S   HC   _H3_    43     1.09957   108.23973   178.12790
   44    42 S   CO4  _C8_    44     1.52519   111.01191    62.59672
   45    44 S   O    _O33    45     1.22369   124.93792  -115.04323
   46    42 S   CT   _C4_    71     1.53224   115.02182   -63.53554
   47    46 S   HC   _H7_    72     1.09450   112.27234    62.14496
   48    46 S   HC   _H8_    73     1.09394   111.44296   -59.65257
   49    46 S   HC   _H9_    74     1.09627   110.34492  -178.68003
   50    44 S   OS   _O34    46     1.36605   109.52876    64.96007
   51    50 S   CT   _C9_    47     1.44133   117.21085  -176.55105
   52    51 S   HC   _H13    48     1.09767   109.02236   -41.27983
   53    51 S   CT   _C10    49     1.53805   107.81305  -158.48757
   54    53 S   HC   _H14    50     1.09717   108.96578    74.42330
   55    53 S   HC   _H15    51     1.09839   109.66061   -40.50211
   56    51 S   CT   _C15    62     1.53934   109.91377    79.22300
   57    56 S   HC   _H20    63     1.09836   109.60993    39.16430
   58    56 S   HC   _H21    64     1.09680   109.41185   -76.00588
   59    53 S   CT   _C11    52     1.53504   112.83721  -163.04014
   60    59 S   HC   _H5_    53     1.09458   111.35346   178.37586
   61    59 S   CT   _C12    54     1.52961   112.91870   -52.43639
   62    61 S   HC   _H16    55     1.09495   112.48508   -35.51341
   63    61 S   HC   _H17    56     1.09649   110.26795  -154.74749
   64    61 S   CT   _C13    57     1.53255   105.62649    87.08985
   65    64 S   HC   _H18    58     1.09646   109.51320   118.90830
   66    64 S   HC   _H19    59     1.09488   111.96815  -122.64861
   67    64 S   CT   _C14    60     1.52973   105.65822     0.13848
   68    67 S   HC   _H6_    61     1.09276   113.94741   144.37952
   69    59 S   NP   _N4_    65     1.51616   106.16889    59.63199
   70    69 S   H    _H22    66     1.02943   109.73063    41.00612
   71    69 S   CT   _C16    67     1.50076   114.92244   160.25196
   72    71 S   HC   _H23    68     1.09214   109.84900    58.86431
   73    71 S   HC   _H24    69     1.09297   107.67576   179.59895
   74    71 S   HC   _H25    70     1.09292   107.65573   -61.85869
  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  10   5   4   3
  14   8   2   1   1   7   3   2   1   9   7  10   3   4   2   1
   1  10  14   8  15   6   5  12   5   4  15   8  10   6   5   7
   4   3   7   3   5   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    42    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    41    42    43    44    46  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    41    42    43    44    45    50    46    47    48    49  
   38    39    40    41    42    43    44    46  
   36    37  
   37  
    0  
   39    40    41    42    43    44    46  
   40    41    42  
   41    42  
   42  
   43    44    45    50    51    46    47    48    49  
   44    45    50    46    47    48    49  
   45    50    51    52    53    56    46    47    48    49  
   50    51    46  
   47    48    49    50  
   48    49  
   49  
    0  
   51    52    53    54    55    59    67    56    57    58  
   52    53    54    55    59    60    61    64    67    68    56    57    58    69  
   53    54    55    59    67    56    57    58  
   54    55    59    60    61    62    63    64    67    56    57    58    69    70    71  
   55    59    60    61    56    69  
   59    60    61    56    69  
   57    58    69    70    71    59    61    64    65    66    67    68  
   58    69    64    67    68  
   69    64    67    68  
   60    61    62    63    64    65    66    67    68    69    70    71    72    73    74  
   61    62    63    64    67    69    70    71  
   62    63    64    65    66    67    68    69    70    71  
   63    64    65    66    67    69  
   64    65    66    67    69  
   65    66    67    68    69    70    71  
   66    67    68    69  
   67    68    69  
   68    69    70    71    72    73    74  
   69    70    71  
   70    71    72    73    74  
   71    72    73    74  
   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   0.107500   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   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   44   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   51   3.5000   0.0660   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.4200   0.0150   0.030000   1.6450   1.4500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   56   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   59   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.6450   1.4500   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   1.6450   1.4500   0.008598240   0.268726247
   63   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   64   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   65   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   66   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   67   3.5000   0.0660   0.210000   1.9750   1.7500   0.005000000  -0.741685710
   68   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   69   3.2500   0.1700  -0.100000   2.1950   1.9500   0.003973653   1.685851020
   70   0.5000   0.0300   0.290000   0.9960   0.8600   0.030040813  -0.651083722
   71   3.5000   0.0660   0.090000   1.9750   1.7500   0.005000000  -0.741685710
   72   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   73   2.5000   0.0300   0.060000   1.6450   1.4500   0.008598240   0.268726247
   74   2.5000   0.0300   0.060000   1.6450   1.4500   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    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   268.000  1.529
   33    42   268.000  1.529
   38    39   340.000  1.090
   38    40   340.000  1.090
   38    41   340.000  1.090
   42    43   340.000  1.090
   42    44   317.000  1.522
   42    46   268.000  1.529
   44    45   570.000  1.229
   44    50   214.000  1.327
   50    51   320.000  1.410
   51    52   340.000  1.090
   51    53   268.000  1.529
   51    56   268.000  1.529
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    59   268.000  1.529
   59    60   340.000  1.090
   59    61   268.000  1.529
   59    69   367.000  1.471
   61    62   340.000  1.090
   61    63   340.000  1.090
   61    64   268.000  1.529
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    67   268.000  1.529
   67    68   340.000  1.090
   67    56   268.000  1.529
   67    69   367.000  1.471
   56    57   340.000  1.090
   56    58   340.000  1.090
   69    70   434.000  1.010
   69    71   367.000  1.471
   71    72   340.000  1.090
   71    73   340.000  1.090
   71    74   340.000  1.090
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   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    75.00000  111.63000
   29    33    42    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    40    37.50000  110.70000
   33    38    41    37.50000  110.70000
   33    42    43    37.50000  110.70000
   33    42    44    63.00000  111.10000
   33    42    46    58.35000  112.70000
   38    33    34    37.50000  110.70000
   40    38    39    33.00000  107.80000
   41    38    39    33.00000  107.80000
   41    38    40    33.00000  107.80000
   42    33    34    37.50000  110.70000
   42    33    38    58.35000  112.70000
   42    44    45    80.00000  120.40000
   42    44    50    81.00000  111.40000
   42    46    47    37.50000  110.70000
   42    46    48    37.50000  110.70000
   42    46    49    37.50000  110.70000
   44    42    43    35.00000  109.50000
   44    50    51    83.00000  116.90000
   50    44    45    83.00000  123.40000
   50    51    52    35.00000  109.50000
   50    51    53    50.00000  109.50000
   50    51    56    50.00000  109.50000
   51    53    54    37.50000  110.70000
   51    53    55    37.50000  110.70000
   51    53    59    58.35000  112.70000
   51    56    67    58.35000  112.70000
   51    56    57    37.50000  110.70000
   51    56    58    37.50000  110.70000
   53    51    52    37.50000  110.70000
   53    59    60    37.50000  110.70000
   53    59    61    58.35000  112.70000
   53    59    69    80.00000  111.20000
   55    53    54    33.00000  107.80000
   59    53    54    37.50000  110.70000
   59    53    55    37.50000  110.70000
   59    61    62    37.50000  110.70000
   59    61    63    37.50000  110.70000
   59    61    64    58.35000  112.70000
   59    69    67    75.00000  113.01200
   59    69    70    35.00000  109.50000
   59    69    71    75.00000  113.01200
   61    59    60    37.50000  110.70000
   61    64    65    37.50000  110.70000
   61    64    66    37.50000  110.70000
   61    64    67    58.35000  112.70000
   63    61    62    33.00000  107.80000
   64    61    62    37.50000  110.70000
   64    61    63    37.50000  110.70000
   64    67    68    37.50000  110.70000
   64    67    56    58.35000  112.70000
   64    67    69    80.00000  111.20000
   66    64    65    33.00000  107.80000
   67    64    65    37.50000  110.70000
   67    64    66    37.50000  110.70000
   67    56    57    37.50000  110.70000
   67    56    58    37.50000  110.70000
   67    69    70    35.00000  109.50000
   67    69    71    75.00000  113.01200
   56    51    52    37.50000  110.70000
   56    51    53    58.35000  112.70000
   56    67    68    37.50000  110.70000
   58    56    57    33.00000  107.80000
   69    59    60    35.00000  109.50000
   69    59    61    80.00000  111.20000
   69    67    68    35.00000  109.50000
   69    67    56    80.00000  111.20000
   69    71    72    35.00000  109.50000
   69    71    73    35.00000  109.50000
   69    71    74    35.00000  109.50000
   71    69    70    35.00000  109.50000
   73    71    72    33.00000  107.80000
   74    71    72    33.00000  107.80000
   74    71    73    33.00000  107.80000
   46    42    43    37.50000  110.70000
   46    42    44    63.00000  111.10000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    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    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   0.01700  1.0 1.0
   24    29    33    38  -0.23550 -1.0 2.0
   24    29    33    38   0.21350  1.0 3.0
   24    29    33    42   0.01700  1.0 1.0
   24    29    33    42  -0.23550 -1.0 2.0
   24    29    33    42   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   0.15000  1.0 3.0
   29    33    38    40   0.15000  1.0 3.0
   29    33    38    41   0.15000  1.0 3.0
   29    33    42    43   0.15000  1.0 3.0
   29    33    42    44   0.56750  1.0 1.0
   29    33    42    44  -0.07550 -1.0 2.0
   29    33    42    44   0.20000  1.0 3.0
   29    33    42    46   0.44750  1.0 1.0
   29    33    42    46  -0.17800 -1.0 2.0
   29    33    42    46   0.20200  1.0 3.0
   33    42    44    45   0.30150 -1.0 2.0
   33    42    44    50   0.36750  1.0 3.0
   33    42    46    47   0.15000  1.0 3.0
   33    42    46    48   0.15000  1.0 3.0
   33    42    46    49   0.15000  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    40   0.15000  1.0 3.0
   34    33    38    41   0.15000  1.0 3.0
   34    33    42    43   0.15000  1.0 3.0
   34    33    42    44  -0.11250  1.0 3.0
   34    33    42    46   0.15000  1.0 3.0
   38    33    42    43   0.15000  1.0 3.0
   38    33    42    44  -0.95700  1.0 1.0
   38    33    42    44  -0.18200 -1.0 2.0
   38    33    42    44   0.29450  1.0 3.0
   38    33    42    46   0.56750  1.0 1.0
   38    33    42    46  -0.07550 -1.0 2.0
   38    33    42    46   0.20000  1.0 3.0
   42    33    38    39   0.15000  1.0 3.0
   42    33    38    40   0.15000  1.0 3.0
   42    33    38    41   0.15000  1.0 3.0
   42    44    50    51   1.63150  1.0 1.0
   42    44    50    51   2.92000 -1.0 2.0
   43    42    44    45   0.00000  1.0 1.0
   43    42    44    50   0.00000  1.0 1.0
   43    42    46    47   0.15000  1.0 3.0
   43    42    46    48   0.15000  1.0 3.0
   43    42    46    49   0.15000  1.0 3.0
   44    42    46    47  -0.11250  1.0 3.0
   44    42    46    48  -0.11250  1.0 3.0
   44    42    46    49  -0.11250  1.0 3.0
   44    50    51    52   0.08050  1.0 3.0
   44    50    51    53  -0.25900  1.0 1.0
   44    50    51    53  -0.47000 -1.0 2.0
   44    50    51    53   0.11750  1.0 3.0
   44    50    51    56  -0.25900  1.0 1.0
   44    50    51    56  -0.47000 -1.0 2.0
   44    50    51    56   0.11750  1.0 3.0
   45    44    50    51   3.00000 -1.0 2.0
   50    51    53    54   0.23400  1.0 3.0
   50    51    53    55   0.23400  1.0 3.0
   50    51    53    59   0.62750  1.0 1.0
   50    51    53    59  -0.30950 -1.0 2.0
   50    51    53    59   0.27300  1.0 3.0
   50    51    56    67   0.62750  1.0 1.0
   50    51    56    67  -0.30950 -1.0 2.0
   50    51    56    67   0.27300  1.0 3.0
   50    51    56    57   0.23400  1.0 3.0
   50    51    56    58   0.23400  1.0 3.0
   51    53    59    60   0.15000  1.0 3.0
   51    53    59    61   0.56750  1.0 1.0
   51    53    59    61  -0.07550 -1.0 2.0
   51    53    59    61   0.20000  1.0 3.0
   51    53    59    69   1.36600  1.0 1.0
   51    53    59    69  -0.11450 -1.0 2.0
   51    53    59    69   0.24250  1.0 3.0
   52    51    53    54   0.15000  1.0 3.0
   52    51    53    55   0.15000  1.0 3.0
   52    51    53    59   0.15000  1.0 3.0
   52    51    56    67   0.15000  1.0 3.0
   52    51    56    57   0.15000  1.0 3.0
   52    51    56    58   0.15000  1.0 3.0
   53    51    56    67   0.56750  1.0 1.0
   53    51    56    67  -0.07550 -1.0 2.0
   53    51    56    67   0.20000  1.0 3.0
   53    51    56    57   0.15000  1.0 3.0
   53    51    56    58   0.15000  1.0 3.0
   53    59    61    62   0.15000  1.0 3.0
   53    59    61    63   0.15000  1.0 3.0
   53    59    61    64   0.56750  1.0 1.0
   53    59    61    64  -0.07550 -1.0 2.0
   53    59    61    64   0.20000  1.0 3.0
   53    59   -69    67   0.47100  1.0 1.0
   53    59    69    70   0.17350  1.0 3.0
   53    59    69    71   0.47100  1.0 1.0
   54    53    59    60   0.15000  1.0 3.0
   54    53    59    61   0.15000  1.0 3.0
   54    53    59    69   0.19200  1.0 3.0
   55    53    59    60   0.15000  1.0 3.0
   55    53    59    61   0.15000  1.0 3.0
   55    53    59    69   0.19200  1.0 3.0
   59    61    64    65   0.15000  1.0 3.0
   59    61    64    66   0.15000  1.0 3.0
   59    61   -64    67   0.56750  1.0 1.0
   59    61   -64    67  -0.07550 -1.0 2.0
   59    61   -64    67   0.20000  1.0 3.0
   59    69    71    72   0.15000  1.0 3.0
   59    69    71    73   0.15000  1.0 3.0
   59    69    71    74   0.15000  1.0 3.0
   60    59    61    62   0.15000  1.0 3.0
   60    59    61    63   0.15000  1.0 3.0
   60    59    61    64   0.15000  1.0 3.0
   60    59    69    67   0.15000  1.0 3.0
   60    59    69    70   0.13050  1.0 3.0
   60    59    69    71   0.15000  1.0 3.0
   61    59   -69    67   0.47100  1.0 1.0
   61    59    69    70   0.17350  1.0 3.0
   61    59    69    71   0.47100  1.0 1.0
   61    64    67    68   0.15000  1.0 3.0
   61    64    67    56   0.56750  1.0 1.0
   61    64    67    56  -0.07550 -1.0 2.0
   61    64    67    56   0.20000  1.0 3.0
   61    64   -67    69   1.36600  1.0 1.0
   61    64   -67    69  -0.11450 -1.0 2.0
   61    64   -67    69   0.24250  1.0 3.0
   62    61    64    65   0.15000  1.0 3.0
   62    61    64    66   0.15000  1.0 3.0
   62    61    64    67   0.15000  1.0 3.0
   63    61    64    65   0.15000  1.0 3.0
   63    61    64    66   0.15000  1.0 3.0
   63    61    64    67   0.15000  1.0 3.0
   64    67    56    51   0.56750  1.0 1.0
   64    67    56    51  -0.07550 -1.0 2.0
   64    67    56    51   0.20000  1.0 3.0
   64    67    56    57   0.15000  1.0 3.0
   64    67    56    58   0.15000  1.0 3.0
   64    67   -69    59   0.47100  1.0 1.0
   64    67    69    70   0.17350  1.0 3.0
   64    67    69    71   0.47100  1.0 1.0
   65    64    67    68   0.15000  1.0 3.0
   65    64    67    56   0.15000  1.0 3.0
   65    64    67    69   0.19200  1.0 3.0
   66    64    67    68   0.15000  1.0 3.0
   66    64    67    56   0.15000  1.0 3.0
   66    64    67    69   0.19200  1.0 3.0
   67    69    71    72   0.15000  1.0 3.0
   67    69    71    73   0.15000  1.0 3.0
   67    69    71    74   0.15000  1.0 3.0
   68    67    56    51   0.15000  1.0 3.0
   68    67    56    57   0.15000  1.0 3.0
   68    67    56    58   0.15000  1.0 3.0
   68    67    69    59   0.15000  1.0 3.0
   68    67    69    70   0.13050  1.0 3.0
   68    67    69    71   0.15000  1.0 3.0
   56    51    53    54   0.15000  1.0 3.0
   56    51    53    55   0.15000  1.0 3.0
   56    51    53    59   0.56750  1.0 1.0
   56    51    53    59  -0.07550 -1.0 2.0
   56    51    53    59   0.20000  1.0 3.0
   56    67   -69    59   0.47100  1.0 1.0
   56    67    69    70   0.17350  1.0 3.0
   56    67    69    71   0.47100  1.0 1.0
   69    59    61    62   0.19200  1.0 3.0
   69    59    61    63   0.19200  1.0 3.0
   69    59   -61    64   1.36600  1.0 1.0
   69    59   -61    64  -0.11450 -1.0 2.0
   69    59   -61    64   0.24250  1.0 3.0
   69    67   -56    51   1.36600  1.0 1.0
   69    67   -56    51  -0.11450 -1.0 2.0
   69    67   -56    51   0.24250  1.0 3.0
   69    67    56    57   0.19200  1.0 3.0
   69    67    56    58   0.19200  1.0 3.0
   70    69    71    72   0.13050  1.0 3.0
   70    69    71    73   0.13050  1.0 3.0
   70    69    71    74   0.13050  1.0 3.0
   46    42    44    45   0.30150 -1.0 2.0
   46    42    44    50   0.36750  1.0 3.0
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
   42    50    44    45  10.50000 -1.0 2.0
END
