* LIGAND DATABASE FILE (OPLS2005)
*
001      89    91    166    254     487
    1     0 S   NP   _N1_     1    28.34994    95.99585   -25.76699
    2     1 S   H    _HN1     2     1.02777   118.25168   -99.62837
    3     1 S   H    _H1_     3     1.02957    75.33927     3.59134
    4     1 S   H    _H2_     4     1.02835    31.71513  -177.73557
    5     1 S   CT   _CA1     5     1.50140   124.03414   108.53218
    6     5 S   HC   _HA1     6     1.09575   105.19989    91.83276
    7     5 S   CO3  _C1_     7     1.53778   112.36039   -28.33542
    8     7 S   O2Z  _O11     8     1.26368   114.99000   -43.59143
    9     7 S   O2Z  _O12     9     1.26233   114.93085   135.44140
   10     5 S   CT   _CB1    10     1.53090   107.41608  -150.26388
   11    10 S   HC   HB11    11     1.09829   109.30884   -50.33997
   12    10 S   HC   HB12    12     1.09815   110.43624    66.20926
   13    10 S   CT   _CG1    13     1.53028   112.69262  -171.39869
   14    13 S   HC   HG11    14     1.09592   110.51550   -65.03763
   15    13 S   HC   HG12    15     1.09659   109.89364    54.17321
   16    13 S   C    _CD1    16     1.51850   112.27888   174.53227
   17    16 S   O    _OE1    17     1.22760   123.26727     1.85287
   18    16 S   N    _N2_    18     1.38572   111.75157  -178.13512
   19    18 S   H    _HN2    19     1.01555   119.03753     4.17631
   20    18 S   CT1  _CA2    20     1.45763   122.79825   177.70971
   21    20 S   HC   _HA2    21     1.09757   108.84610    25.16685
   22    20 S   C    _C2_    22     1.52982   107.49731   -91.62653
   23    22 S   O    _O2_    23     1.22950   123.15142   -25.10854
   24    20 S   CT   _CB2    32     1.53189   112.21823   148.35029
   25    24 S   HC   HB21    33     1.09578   110.62703    50.78306
   26    24 S   HC   HB22    34     1.09355   109.50179   169.82320
   27    22 S   N    _N3_    24     1.38579   112.37955   157.62632
   28    27 S   H    _HN3    25     1.01667   120.27764    -2.44120
   29    24 S   S    _SG2    35     1.82415   111.00266   -70.30260
   30    27 S   CT   _CA3    26     1.45333   122.64277   178.17265
   31    30 S   HC   HA31    27     1.09565   107.85999   -54.20568
   32    30 S   HC   HA32    28     1.09555   107.57214    62.15255
   33    29 S   CT   _C15    36     1.85223   100.25533   176.84918
   34    33 S   HC   _H3_    37     1.09797   103.71075   -64.00547
   35    30 S   CO3  _C3_    29     1.52927   114.27293  -176.16483
   36    35 S   O2Z  _O31    30     1.26337   116.08911    -1.10906
   37    35 S   O2Z  _O32    31     1.26435   114.41611   178.88812
   38    33 S   CT   _C14    38     1.54474   114.41065    51.54039
   39    38 S   HC   _H38    39     1.09653   111.20321   -74.96237
   40    33 S   CT   _C18    52     1.58262   118.58764   177.28012
   41    40 S   OM   _O21    53     1.32573   112.22795   -24.23297
   42    38 S   CT   _C12    40     1.53274   103.84917   164.59010
   43    42 S   HC   _H36    41     1.09765   110.79368  -158.53885
   44    40 S   CT   _C21    54     1.54967   110.35583    95.70564
   45    44 S   HC   _H48    55     1.09583   113.07740  -175.61322
   46    44 S   HC   _H49    56     1.09370   111.15921    63.40890
   47    38 S   OS   _O26    75     1.44139   109.74494    47.78214
   48    42 S   CT   _C11    42     1.53462   112.84290    79.42522
   49    48 S   HC   _H34    43     1.09472   110.45624   -43.02167
   50    48 S   HC   _H35    44     1.09662   108.93545    74.27532
   51    44 S   OH   _O25    57     1.42970   111.54098   -55.00342
   52    51 S   HO   _H55    58     0.97421   105.73410   -45.10400
   53    47 S   CO4  _C10    76     1.35495   117.15116  -156.23658
   54    53 S   O    _O22    77     1.22033   126.85485    -3.00843
   55    48 S   CO   _C16    45     1.52697   111.88795  -163.54842
   56    55 S   HC   _H40    46     1.09667   107.86449   171.24485
   57    53 S   CA   _C8_    78     1.48126   109.53719   174.77753
   58    55 S   OS   _O23    47     1.42996   109.93058    54.49030
   59    55 S   OS   _O27    67     1.43045   109.16961   -71.10089
   60    57 S   CA   _C4_    79     1.40134   122.02854    19.84610
   61    60 S   HA   _H30    80     1.08714   121.46048     0.46814
   62    58 S   CO   _C17    48     1.42860   113.09432   -62.62180
   63    62 S   HC   _H41    49     1.09843   108.52985   -57.10716
   64    59 S   CT   _C22    68     1.42569   112.37258  -168.41736
   65    64 S   HC   _H50    69     1.09517   110.12754   -58.96293
   66    64 S   HC   _H51    70     1.09536   109.71858    61.21727
   67    60 S   CA   _C6_    81     1.39599   119.95339  -179.75451
   68    67 S   HA   _H32    82     1.08639   119.78833   179.92338
   69    42 S   CT   _C13    50     1.54024   103.32082   -42.19133
   70    69 S   HC   _H37    51     1.10420   106.43363   -79.17133
   71    62 S   OS   _O28    59     1.43032   112.07509  -175.21459
   72    64 S   CT   _C19    71     1.51566   108.28140  -178.90282
   73    72 S   HC   _H42    72     1.09502   110.63016   -58.98552
   74    72 S   HC   _H43    73     1.09508   110.57970    59.27551
   75    72 S   HC   _H44    74     1.09355   110.91335  -179.87805
   76    67 S   CA   _C9_    83     1.39230   119.74424     0.02798
   77    71 S   CT   _C23    60     1.42451   112.66205    65.65271
   78    77 S   HC   _H52    61     1.09511   110.05986   -60.97219
   79    77 S   HC   _H53    62     1.09543   109.86022    59.26379
   80    76 S   CA   _C7_    84     1.39291   120.80067    -0.18345
   81    80 S   HA   _H33    85     1.08613   121.04758   179.69481
   82    76 S   OH   _O24    88     1.36633   118.18922   179.77619
   83    82 S   HO   _H54    89     0.97246   108.49580  -179.04941
   84    77 S   CT   _C20    63     1.51577   108.25518   179.17244
   85    84 S   HC   _H45    64     1.09504   110.61561   -59.10822
   86    84 S   HC   _H46    65     1.09508   110.59668    59.14025
   87    84 S   HC   _H47    66     1.09355   110.91570  -180.00000
   88    57 S   CA   _C5_    86     1.40072   118.17994  -160.21006
   89    88 S   HA   _H31    87     1.08747   120.98277     0.52339
  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
  17   8   2   1   1  17   7  16   8  16   8   7   4   3   7  10
   6   5   2   1   8   3  11   4   9   8   8   8   4   8   4   6
   5   4   7   3   3   1   7   3   2   1   1   6   6   5   4   5
   3   2   1   3   2   1   1   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    42    69    40    41    44    47  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    42    43    48    62    69    70    40    41    44    45    46    51    47    53  
   38    39    42    69    40    41    44    47  
   36    37  
   37  
    0  
   39    42    43    48    49    50    55    62    69    70    40    41    44    47    53    54    57  
   42    43    48    69    40    47    53  
   41    44    45    46    51    52    71    47    42    43    48    58    62    63    69    70  
   44    45    46    51    42    62    69    70  
   43    48    49    50    55    56    58    62    63    69    70    44    71    59    47    53  
   48    49    50    55    62    69    70    47  
   45    46    51    52    62    69    70  
   46    51    52    69  
   51    52    69  
   53    54    57    60    88    48    69  
   49    50    55    56    58    62    69    70    59    64  
   50    55    56    58    69    59  
   55    56    58    69    59  
   52    69  
    0  
   54    57    60    61    67    80    88    89  
   57    60    88  
   56    58    62    63    69    71    59    64    65    66    72  
   58    62    59    64  
   60    61    67    68    76    80    81    88    89  
   62    63    69    70    71    77    59    64  
   64    65    66    72    73    74    75    62  
   61    67    68    76    80    88    89    82  
   67    68    76    88  
   63    69    70    71    77    78    79    84  
   69    70    71    77  
   65    66    72    73    74    75  
   66    72    73    74    75  
   72    73    74    75  
   68    76    80    81    88    82    83  
   76    80    82  
   70    71    77  
   71  
   77    78    79    84    85    86    87  
   73    74    75  
   74    75  
   75  
    0  
   80    81    88    89    82    83  
   78    79    84    85    86    87  
   79    84    85    86    87  
   84    85    86    87  
   81    88    89    82    83  
   88    89    82  
   83    88  
    0  
   85    86    87  
   86    87  
   87  
    0  
   89  
    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   0.220000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.4200   0.0150   0.030000   1.3810   1.2100   0.008598240   0.268726247
   40   4.2000   0.3000  -0.020000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   42   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   3.5000   0.0660   0.145000   1.9750   1.7500   0.005000000  -0.741685710
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   3.0000   0.1700  -0.330000   1.7660   1.5600   0.020110767  -0.896042159
   48   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   51   3.1200   0.1700  -0.683000   1.7660   1.5600   0.021068034  -0.322181743
   52   0.5000   0.0300   0.418000   0.9960   0.8600   0.030040813  -0.651083722
   53   3.7500   0.1050   0.625000   2.1120   1.8750   0.001000000  -0.126889456
   54   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   55   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   56   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   58   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   59   2.9000   0.1400  -0.400000   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   3.5000   0.0660   0.300000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.100000   1.4250   1.2500   0.008598240   0.268726247
   64   3.5000   0.0660   0.140000   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   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   68   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   69   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   70   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   71   2.9000   0.1400  -0.400000   1.7660   1.5600   0.020110767  -0.896042159
   72   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.5500   0.0700   0.150000   2.0020   1.7750   0.001000000  -0.843144165
   77   3.5000   0.0660   0.140000   1.9750   1.7500   0.005000000  -0.741685710
   78   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   79   2.5000   0.0300   0.030000   1.4250   1.2500   0.008598240   0.268726247
   80   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   81   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   82   3.0700   0.1700  -0.585000   1.7660   1.5600   0.021068034  -0.322181743
   83   0.5000   0.0300   0.435000   0.9960   0.8600   0.030040813  -0.651083722
   84   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   85   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   89   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   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    40   268.000  1.529
   38    39   340.000  1.090
   38    42   268.000  1.529
   38    47   320.000  1.410
   42    43   340.000  1.090
   42    48   268.000  1.529
   42    69   268.000  1.529
   48    49   340.000  1.090
   48    50   340.000  1.090
   48    55   250.000  1.527
   55    56   340.000  1.090
   55    58   320.000  1.380
   55    59   320.000  1.380
   58    62   320.000  1.380
   62    63   340.000  1.090
   62    69   250.000  1.527
   62    71   320.000  1.380
   69    70   340.000  1.090
   69    40   268.000  1.529
   40    41   570.000  1.307
   40    44   268.000  1.529
   44    45   340.000  1.090
   44    46   340.000  1.090
   44    51   320.000  1.410
   51    52   553.000  0.945
   71    77   320.000  1.410
   77    78   340.000  1.090
   77    79   340.000  1.090
   77    84   268.000  1.529
   84    85   340.000  1.090
   84    86   340.000  1.090
   84    87   340.000  1.090
   59    64   320.000  1.410
   64    65   340.000  1.090
   64    66   340.000  1.090
   64    72   268.000  1.529
   72    73   340.000  1.090
   72    74   340.000  1.090
   72    75   340.000  1.090
   47    53   214.000  1.327
   53    54   570.000  1.229
   53    57   310.000  1.470
   57    60   469.000  1.400
   57    88   469.000  1.400
   60    61   367.000  1.080
   60    67   469.000  1.400
   67    68   367.000  1.080
   67    76   469.000  1.400
   76    80   469.000  1.400
   76    82   450.000  1.364
   80    81   367.000  1.080
   80    88   469.000  1.400
   88    89   367.000  1.080
   82    83   553.000  0.945
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    40    75.00000  111.63000
   33    38    39    37.50000  110.70000
   33    38    42    58.35000  112.70000
   33    38    47    50.00000  109.50000
   33    40    69    58.35000  112.70000
   33    40    41    50.00000  109.50000
   33    40    44    58.35000  112.70000
   38    33    34    37.50000  110.70000
   38    42    43    37.50000  110.70000
   38    42    48    58.35000  112.70000
   38    42    69    58.35000  112.70000
   38    47    53    83.00000  116.90000
   42    38    39    37.50000  110.70000
   42    48    49    37.50000  110.70000
   42    48    50    37.50000  110.70000
   42    48    55    75.00000  109.43000
   42    69    62    75.00000  109.43000
   42    69    70    37.50000  110.70000
   42    69    40    58.35000  112.70000
   48    42    43    37.50000  110.70000
   48    55    56    45.00000  112.01100
   48    55    58    90.00000  108.56700
   48    55    59    90.00000  108.56700
   50    48    49    33.00000  107.80000
   55    48    49    45.00000  108.72000
   55    48    50    45.00000  108.72000
   55    58    62   100.00000  109.58800
   55    59    64    60.00000  109.50000
   58    55    56    35.00000  109.50000
   58    62    63    35.00000  109.50000
   58    62    69    90.00000  108.56700
   58    62    71    92.60000  111.55000
   62    69    70    45.00000  108.72000
   62    69    40    75.00000  109.43000
   62    71    77    60.00000  109.50000
   69    42    43    37.50000  110.70000
   69    42    48    58.35000  112.70000
   69    62    63    45.00000  112.01100
   69    40    41    50.00000  109.50000
   69    40    44    58.35000  112.70000
   40    33    34    37.50000  110.70000
   40    33    38    58.35000  112.70000
   40    69    70    37.50000  110.70000
   40    44    45    37.50000  110.70000
   40    44    46    37.50000  110.70000
   40    44    51    50.00000  109.50000
   44    40    41    50.00000  109.50000
   44    51    52    55.00000  108.50000
   46    44    45    33.00000  107.80000
   51    44    45    35.00000  109.50000
   51    44    46    35.00000  109.50000
   71    62    63    35.00000  109.50000
   71    62    69    90.00000  108.56700
   71    77    78    35.00000  109.50000
   71    77    79    35.00000  109.50000
   71    77    84    50.00000  109.50000
   77    84    85    37.50000  110.70000
   77    84    86    37.50000  110.70000
   77    84    87    37.50000  110.70000
   79    77    78    33.00000  107.80000
   84    77    78    37.50000  110.70000
   84    77    79    37.50000  110.70000
   86    84    85    33.00000  107.80000
   87    84    85    33.00000  107.80000
   87    84    86    33.00000  107.80000
   59    55    56    35.00000  109.50000
   59    55    58    92.60000  111.55000
   59    64    65    35.00000  109.50000
   59    64    66    35.00000  109.50000
   59    64    72    50.00000  109.50000
   64    72    73    37.50000  110.70000
   64    72    74    37.50000  110.70000
   64    72    75    37.50000  110.70000
   66    64    65    33.00000  107.80000
   72    64    65    37.50000  110.70000
   72    64    66    37.50000  110.70000
   74    72    73    33.00000  107.80000
   75    72    73    33.00000  107.80000
   75    72    74    33.00000  107.80000
   47    38    39    35.00000  109.50000
   47    38    42    50.00000  109.50000
   47    53    54    83.00000  123.40000
   47    53    57    81.00000  111.40000
   53    57    60    60.00000  119.52600
   53    57    88    60.00000  119.52600
   57    53    54    75.00000  123.78400
   57    60    61    35.00000  120.00000
   57    60    67    63.00000  120.00000
   57    88    80    63.00000  120.00000
   57    88    89    35.00000  120.00000
   60    67    68    35.00000  120.00000
   60    67    76    63.00000  120.00000
   67    60    61    35.00000  120.00000
   67    76    80    63.00000  120.00000
   67    76    82    70.00000  120.00000
   76    67    68    35.00000  120.00000
   76    80    81    35.00000  120.00000
   76    80    88    63.00000  120.00000
   76    82    83    35.00000  113.00000
   80    88    89    35.00000  120.00000
   88    57    60    63.00000  120.00000
   88    80    81    35.00000  120.00000
   82    76    80    70.00000  120.00000
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    40   0.01700  1.0 1.0
   24    29    33    40  -0.23550 -1.0 2.0
   24    29    33    40   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    42   0.44750  1.0 1.0
   29    33    38    42  -0.17800 -1.0 2.0
   29    33    38    42   0.20200  1.0 3.0
   29    33    38    47   0.56750  1.0 1.0
   29    33    38    47  -0.07550 -1.0 2.0
   29    33    38    47   0.20000  1.0 3.0
   29    33    40    69   0.44750  1.0 1.0
   29    33    40    69  -0.17800 -1.0 2.0
   29    33    40    69   0.20200  1.0 3.0
   29    33    40    41   0.56750  1.0 1.0
   29    33    40    41  -0.07550 -1.0 2.0
   29    33    40    41   0.20000  1.0 3.0
   29    33    40    44   0.44750  1.0 1.0
   29    33    40    44  -0.17800 -1.0 2.0
   29    33    40    44   0.20200  1.0 3.0
   33    38    42    43   0.15000  1.0 3.0
   33    38    42    48   0.56750  1.0 1.0
   33    38    42    48  -0.07550 -1.0 2.0
   33    38    42    48   0.20000  1.0 3.0
   33    38   -42    69   0.56750  1.0 1.0
   33    38   -42    69  -0.07550 -1.0 2.0
   33    38   -42    69   0.20000  1.0 3.0
   33    38    47    53  -0.25900  1.0 1.0
   33    38    47    53  -0.47000 -1.0 2.0
   33    38    47    53   0.11750  1.0 3.0
   33    40    44    45   0.15000  1.0 3.0
   33    40    44    46   0.15000  1.0 3.0
   33    40    44    51   0.86500  1.0 1.0
   33    40    44    51  -0.17500 -1.0 2.0
   33    40    44    51   0.20800  1.0 3.0
   34    33    38    39   0.15000  1.0 3.0
   34    33    38    42   0.15000  1.0 3.0
   34    33    38    47   0.23400  1.0 3.0
   34    33    40    69   0.15000  1.0 3.0
   34    33    40    41   0.23400  1.0 3.0
   34    33    40    44   0.15000  1.0 3.0
   38    33   -40    69   0.56750  1.0 1.0
   38    33   -40    69  -0.07550 -1.0 2.0
   38    33   -40    69   0.20000  1.0 3.0
   38    33    40    41   0.62750  1.0 1.0
   38    33    40    41  -0.30950 -1.0 2.0
   38    33    40    41   0.27300  1.0 3.0
   38    33    40    44   0.56750  1.0 1.0
   38    33    40    44  -0.07550 -1.0 2.0
   38    33    40    44   0.20000  1.0 3.0
   38    42    48    49   0.15000  1.0 3.0
   38    42    48    50   0.15000  1.0 3.0
   38    42    48    55   3.97050  1.0 1.0
   38    42    69    62   3.97050  1.0 1.0
   38    42    69    70   0.15000  1.0 3.0
   38    42   -69    40   0.56750  1.0 1.0
   38    42   -69    40  -0.07550 -1.0 2.0
   38    42   -69    40   0.20000  1.0 3.0
   38    47    53    54   3.00000 -1.0 2.0
   38    47    53    57   0.59950  1.0 1.0
   38    47    53    57   3.24850 -1.0 2.0
   39    38    42    43   0.15000  1.0 3.0
   39    38    42    48   0.15000  1.0 3.0
   39    38    42    69   0.15000  1.0 3.0
   39    38    47    53   0.08050  1.0 3.0
   42    38    47    53  -0.25900  1.0 1.0
   42    38    47    53  -0.47000 -1.0 2.0
   42    38    47    53   0.11750  1.0 3.0
   42    48    55    56   0.15000  1.0 3.0
   42    48    55    58   0.62750  1.0 1.0
   42    48    55    58  -0.30950 -1.0 2.0
   42    48    55    58   0.27300  1.0 3.0
   42    48    55    59   0.62750  1.0 1.0
   42    48    55    59  -0.30950 -1.0 2.0
   42    48    55    59   0.27300  1.0 3.0
   42    69   -40    33   0.56750  1.0 1.0
   42    69   -40    33  -0.07550 -1.0 2.0
   42    69   -40    33   0.20000  1.0 3.0
   42    69    40    41   0.62750  1.0 1.0
   42    69    40    41  -0.30950 -1.0 2.0
   42    69    40    41   0.27300  1.0 3.0
   42    69    40    44   0.56750  1.0 1.0
   42    69    40    44  -0.07550 -1.0 2.0
   42    69    40    44   0.20000  1.0 3.0
   43    42    48    49   0.15000  1.0 3.0
   43    42    48    50   0.15000  1.0 3.0
   43    42    48    55   0.15000  1.0 3.0
   43    42    69    62   0.15000  1.0 3.0
   43    42    69    70   0.15000  1.0 3.0
   43    42    69    40   0.15000  1.0 3.0
   48    42    69    62   3.97050  1.0 1.0
   48    42    69    70   0.15000  1.0 3.0
   48    42    69    40   0.56750  1.0 1.0
   48    42    69    40  -0.07550 -1.0 2.0
   48    42    69    40   0.20000  1.0 3.0
   48    55   -58    62   0.06250  1.0 1.0
   48    55   -58    62  -0.01100 -1.0 2.0
   48    55   -58    62   0.28050  1.0 3.0
   48    55    59    64   0.06250  1.0 1.0
   48    55    59    64  -0.01100 -1.0 2.0
   48    55    59    64   0.28050  1.0 3.0
   49    48    55    56   0.15000  1.0 3.0
   49    48    55    58   0.23400  1.0 3.0
   49    48    55    59   0.23400  1.0 3.0
   50    48    55    56   0.15000  1.0 3.0
   50    48    55    58   0.23400  1.0 3.0
   50    48    55    59   0.23400  1.0 3.0
   55    58    62    63   0.37050  1.0 3.0
   55    58    62    69   0.06250  1.0 1.0
   55    58    62    69  -0.01100 -1.0 2.0
   55    58    62    69   0.28050  1.0 3.0
   55    58    62    71  -0.81800  1.0 1.0
   55    59    64    65   0.37050  1.0 3.0
   55    59    64    66   0.37050  1.0 3.0
   55    59    64    72   0.06250  1.0 1.0
   55    59    64    72  -0.01100 -1.0 2.0
   55    59    64    72   0.28050  1.0 3.0
   56    55    58    62   0.37050  1.0 3.0
   56    55    59    64   0.37050  1.0 3.0
   58    55    59    64  -0.53350  1.0 1.0
   58    55    59    64  -0.78350 -1.0 2.0
   58    55    59    64   0.33750  1.0 3.0
   58    62   -69    42   0.62750  1.0 1.0
   58    62   -69    42  -0.30950 -1.0 2.0
   58    62   -69    42   0.27300  1.0 3.0
   58    62    69    70   0.23400  1.0 3.0
   58    62    69    40   0.62750  1.0 1.0
   58    62    69    40  -0.30950 -1.0 2.0
   58    62    69    40   0.27300  1.0 3.0
   58    62    71    77  -0.53350  1.0 1.0
   58    62    71    77  -0.78350 -1.0 2.0
   58    62    71    77   0.33750  1.0 3.0
   62    69    40    33   3.97050  1.0 1.0
   62    69    40    41   0.62750  1.0 1.0
   62    69    40    41  -0.30950 -1.0 2.0
   62    69    40    41   0.27300  1.0 3.0
   62    69    40    44   3.97050  1.0 1.0
   62    71    77    78   0.37050  1.0 3.0
   62    71    77    79   0.37050  1.0 3.0
   62    71    77    84   0.06250  1.0 1.0
   62    71    77    84  -0.01100 -1.0 2.0
   62    71    77    84   0.28050  1.0 3.0
   63    62    69    42   0.15000  1.0 3.0
   63    62    69    70   0.15000  1.0 3.0
   63    62    69    40   0.15000  1.0 3.0
   63    62    71    77   0.37050  1.0 3.0
   69    42    48    49   0.15000  1.0 3.0
   69    42    48    50   0.15000  1.0 3.0
   69    42   -48    55   3.97050  1.0 1.0
   69    62    71    77   0.06250  1.0 1.0
   69    62    71    77  -0.01100 -1.0 2.0
   69    62    71    77   0.28050  1.0 3.0
   69    40    44    45   0.15000  1.0 3.0
   69    40    44    46   0.15000  1.0 3.0
   69    40    44    51   0.86500  1.0 1.0
   69    40    44    51  -0.17500 -1.0 2.0
   69    40    44    51   0.20800  1.0 3.0
   70    69    40    33   0.15000  1.0 3.0
   70    69    40    41   0.23400  1.0 3.0
   70    69    40    44   0.15000  1.0 3.0
   40    33    38    39   0.15000  1.0 3.0
   40    33   -38    42   0.56750  1.0 1.0
   40    33   -38    42  -0.07550 -1.0 2.0
   40    33   -38    42   0.20000  1.0 3.0
   40    33    38    47   0.62750  1.0 1.0
   40    33    38    47  -0.30950 -1.0 2.0
   40    33    38    47   0.27300  1.0 3.0
   40    44    51    52  -0.11600  1.0 1.0
   40    44    51    52  -0.09450 -1.0 2.0
   40    44    51    52   0.21250  1.0 3.0
   41    40    44    45   0.23400  1.0 3.0
   41    40    44    46   0.23400  1.0 3.0
   41    40    44    51   3.69350  1.0 1.0
   41    40    44    51  -1.82950 -1.0 2.0
   45    44    51    52   0.19450  1.0 3.0
   46    44    51    52   0.19450  1.0 3.0
   71    62    69    42   0.62750  1.0 1.0
   71    62    69    42  -0.30950 -1.0 2.0
   71    62    69    42   0.27300  1.0 3.0
   71    62    69    70   0.23400  1.0 3.0
   71    62    69    40   0.62750  1.0 1.0
   71    62    69    40  -0.30950 -1.0 2.0
   71    62    69    40   0.27300  1.0 3.0
   71    77    84    85   0.23400  1.0 3.0
   71    77    84    86   0.23400  1.0 3.0
   71    77    84    87   0.23400  1.0 3.0
   78    77    84    85   0.15000  1.0 3.0
   78    77    84    86   0.15000  1.0 3.0
   78    77    84    87   0.15000  1.0 3.0
   79    77    84    85   0.15000  1.0 3.0
   79    77    84    86   0.15000  1.0 3.0
   79    77    84    87   0.15000  1.0 3.0
   59    55    58    62  -0.81800  1.0 1.0
   59    64    72    73   0.23400  1.0 3.0
   59    64    72    74   0.23400  1.0 3.0
   59    64    72    75   0.23400  1.0 3.0
   65    64    72    73   0.15000  1.0 3.0
   65    64    72    74   0.15000  1.0 3.0
   65    64    72    75   0.15000  1.0 3.0
   66    64    72    73   0.15000  1.0 3.0
   66    64    72    74   0.15000  1.0 3.0
   66    64    72    75   0.15000  1.0 3.0
   47    38    42    43   0.23400  1.0 3.0
   47    38    42    48   0.62750  1.0 1.0
   47    38    42    48  -0.30950 -1.0 2.0
   47    38    42    48   0.27300  1.0 3.0
   47    38    42    69   0.62750  1.0 1.0
   47    38    42    69  -0.30950 -1.0 2.0
   47    38    42    69   0.27300  1.0 3.0
   47    53    57    60   0.98750 -1.0 2.0
   47    53    57    88   0.98750 -1.0 2.0
   53    57    60    61   3.62500 -1.0 2.0
   53    57    60    67   3.62500 -1.0 2.0
   53    57    88    80   3.62500 -1.0 2.0
   53    57    88    89   3.62500 -1.0 2.0
   54    53    57    60   1.05000 -1.0 2.0
   54    53    57    88   1.05000 -1.0 2.0
   57    60    67    68   3.62500 -1.0 2.0
   57    60    67    76   3.62500 -1.0 2.0
   60    57    88    80   3.62500 -1.0 2.0
   60    57    88    89   3.62500 -1.0 2.0
   60    67   -76    80   3.62500 -1.0 2.0
   60    67    76    82   3.62500 -1.0 2.0
   61    60    67    68   3.62500 -1.0 2.0
   61    60    67    76   3.62500 -1.0 2.0
   67    76    80    81   3.62500 -1.0 2.0
   67    76    80    88   3.62500 -1.0 2.0
   67    76    82    83   0.84100 -1.0 2.0
   68    67    76    80   3.62500 -1.0 2.0
   68    67    76    82   3.62500 -1.0 2.0
   76    80   -88    57   3.62500 -1.0 2.0
   76    80    88    89   3.62500 -1.0 2.0
   80    76    82    83   0.84100 -1.0 2.0
   81    80    88    57   3.62500 -1.0 2.0
   81    80    88    89   3.62500 -1.0 2.0
   88    57    60    61   3.62500 -1.0 2.0
   88    57   -60    67   3.62500 -1.0 2.0
   82    76    80    81   3.62500 -1.0 2.0
   82    76    80    88   3.62500 -1.0 2.0
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
   37    30    35    36  10.50000 -1.0 2.0
   47    57    53    54  10.50000 -1.0 2.0
   60    88    57    53   4.00000 -1.0 2.0
   67    61    60    57   1.10000 -1.0 2.0
   76    68    67    60   1.10000 -1.0 2.0
   80    82    76    67   4.00000 -1.0 2.0
   88    81    80    76   1.10000 -1.0 2.0
   80    89    88    57   1.10000 -1.0 2.0
END
