* LIGAND DATABASE FILE (OPLS2005)
*
001      59    58    100    148     293
    1     0 S   NP   _N1_     1    28.74419    93.71389   -22.67792
    2     1 S   H    _HN1     2     1.02951    89.53757    13.13814
    3     1 S   H    _H1_     3     1.02839    24.05041   151.12424
    4     1 S   H    _H2_     4     1.02790    99.14542   -95.31218
    5     1 S   CT   _CA1     5     1.50131   133.76931   131.62154
    6     5 S   HC   _HA1     6     1.09585   105.21069    67.86783
    7     5 S   CO3  _C1_     7     1.53839   112.03445   -52.21693
    8     7 S   O2Z  _O11     8     1.26370   115.06704   -51.93072
    9     7 S   O2Z  _O12     9     1.26231   114.86101   126.86027
   10     5 S   CT   _CB1    10     1.53084   107.36302  -174.43863
   11    10 S   HC   HB11    11     1.09833   109.42029   -50.45006
   12    10 S   HC   HB12    12     1.09815   110.47187    66.12558
   13    10 S   CT   _CG1    13     1.52995   112.57999  -171.44572
   14    13 S   HC   HG11    14     1.09567   110.46332   -62.31347
   15    13 S   HC   HG12    15     1.09653   109.98733    56.88948
   16    13 S   C    _CD1    16     1.51841   112.17844   177.25790
   17    16 S   O    _OE1    17     1.22745   123.25655    -1.23796
   18    16 S   N    _N2_    18     1.38630   111.73237   178.73082
   19    18 S   H    _HN2    19     1.01601   118.99199     1.63698
   20    18 S   CT1  _CA2    20     1.46296   123.35503  -179.70993
   21    20 S   HC   _HA2    21     1.09737   109.32924    -8.02796
   22    20 S   C    _C2_    22     1.53377   108.51847  -123.57542
   23    22 S   O    _O2_    23     1.23033   122.35952  -148.02246
   24    20 S   CT   _CB2    32     1.53373   111.46163   113.91468
   25    24 S   HC   HB21    33     1.09672   109.87641    56.46521
   26    24 S   HC   HB22    34     1.09553   110.68681   175.20825
   27    22 S   N    _N3_    24     1.38366   113.49995    39.52706
   28    27 S   H    _HN3    25     1.01640   119.50622    -3.71404
   29    24 S   S    _SG2    35     1.82410   111.45526   -64.60121
   30    27 S   CT   _CA3    26     1.45290   123.10267   176.87764
   31    30 S   HC   HA31    27     1.09553   107.54710   -63.25056
   32    30 S   HC   HA32    28     1.09559   107.91609    53.14416
   33    29 S   CM   _C8_    36     1.73559    99.74630   167.43875
   34    33 S   HC   _H3_    37     1.08652   114.76093    49.38651
   35    30 S   CO3  _C3_    29     1.52931   114.15953   175.12798
   36    35 S   O2Z  _O31    30     1.26362   116.06250    -0.34548
   37    35 S   O2Z  _O32    31     1.26430   114.40874   179.70525
   38    33 S   CM   _C10    38     1.34779   124.90748  -129.62068
   39    38 S   CM   _C5_    39     1.45649   124.91283    -1.79450
   40    39 S   HC   _H17    40     1.08798   116.45609   -20.30475
   41    38 S   CO4  _C9_    57     1.49756   115.04882  -179.31844
   42    41 S   O    _O33    58     1.22578   124.50376   -14.52570
   43    41 S   HC   _H21    59     1.10222   115.22644   164.99885
   44    39 S   CM   _C7_    41     1.34364   126.09179   156.77065
   45    44 S   HC   _H19    42     1.08683   120.34420     0.75095
   46    44 S   CT   _C12    43     1.51341   122.93152  -177.16013
   47    46 S   Cl   CL13    44     1.80364   106.95694  -122.10218
   48    46 S   HC   _H25    45     1.09736   109.24169    -9.54048
   49    46 S   CT   _C13    46     1.56405   115.39421   112.96453
   50    49 S   Cl   CL14    47     1.82499   108.26290   -57.71286
   51    49 S   CM   _C6_    48     1.52244   112.79968    58.82344
   52    51 S   HC   _H18    49     1.08954   116.26070   -62.34847
   53    49 S   CT   _C11    53     1.54180   110.17438  -172.73599
   54    53 S   HC   _H22    54     1.09645   111.13051    54.53897
   55    53 S   HC   _H23    55     1.09527   112.16870   -65.34007
   56    53 S   HC   _H24    56     1.09694   111.63518   174.22647
   57    51 S   CM   _C4_    50     1.33953   127.49112   117.98829
   58    57 S   HC   _H15    51     1.08538   120.08817   179.79923
   59    57 S   HC   _H16    52     1.08337   122.71812    -0.30067
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   5   5   4   3
   8   3   2   1   1   8  10   4   3   1   1   8   4  11   5   4
  10   7   8   4   4   2   1   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    44    41    42    43  
   38    39    41  
   36    37  
   37  
    0  
   39    40    44    45    46    41    42    43  
   40    44    45    46    47    48    49    41    42    43  
   44    45    46    41  
   42    43    44  
   43  
    0  
   45    46    47    48    49    50    51    53  
   46    47    48    49  
   47    48    49    50    51    52    57    53    54    55    56  
   48    49    50    51    53  
   49    50    51    53  
   50    51    52    57    58    59    53    54    55    56  
   51    52    57    53    54    55    56  
   52    57    58    59    53    54    55    56  
   57    58    59    53  
   54    55    56    57  
   55    56  
   56  
    0  
   58    59  
   59  
    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  -0.175000   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   3.5500   0.0760  -0.107500   2.0020   1.7750   0.023028004  -0.852763146
   34   2.4200   0.0300   0.115000   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   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   39   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   40   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   41   3.7500   0.1050   0.450000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.450000   1.6780   1.4800   0.001000000  -0.126889456
   43   2.4200   0.0150   0.000000   1.3810   1.2100   0.008598240   0.268726247
   44   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   45   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   47   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   48   2.5000   0.0300   0.103000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5000   0.0660   0.200000   1.9750   1.7500   0.005000000  -0.741685710
   50   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   51   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   52   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   53   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760  -0.230000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   2.4200   0.0300   0.115000   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    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   240.000  1.763
   33    34   340.000  1.080
   33    38   549.000  1.340
   38    39   380.000  1.444
   38    41   320.000  1.462
   39    40   340.000  1.080
   39    44   549.000  1.340
   44    45   340.000  1.080
   44    46   317.000  1.510
   46    47   245.000  1.781
   46    48   340.000  1.090
   46    49   268.000  1.529
   49    50   245.000  1.781
   49    51   317.000  1.510
   49    53   268.000  1.529
   51    52   340.000  1.080
   51    57   549.000  1.340
   57    58   340.000  1.080
   57    59   340.000  1.080
   53    54   340.000  1.090
   53    55   340.000  1.090
   53    56   340.000  1.090
   41    42   570.000  1.229
   41    43   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    85.00000  102.41200
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    34    40.00000  115.49800
   29    33    38    65.00000  122.11800
   33    38    39    70.00000  123.01800
   33    38    41    65.00000  118.96000
   38    33    34    35.00000  120.00000
   38    39    40    35.00000  120.00000
   38    39    44    70.00000  123.01800
   38    41    42    80.00000  123.72100
   38    41    43    40.00000  115.75000
   39    44    45    35.00000  120.00000
   39    44    46    70.00000  124.00000
   44    39    40    35.00000  120.00000
   44    46    47    75.00000  111.90500
   44    46    48    35.00000  109.50000
   44    46    49    70.00000  112.02700
   46    44    45    35.00000  117.00000
   46    49    50    69.00000  109.80000
   46    49    51    70.00000  112.02700
   46    49    53    58.35000  112.70000
   48    46    47    51.00000  107.60000
   49    46    47    69.00000  109.80000
   49    46    48    37.50000  110.70000
   49    51    52    35.00000  117.00000
   49    51    57    70.00000  124.00000
   49    53    54    37.50000  110.70000
   49    53    55    37.50000  110.70000
   49    53    56    37.50000  110.70000
   51    49    50    75.00000  111.90500
   51    57    58    35.00000  120.00000
   51    57    59    35.00000  120.00000
   57    51    52    35.00000  120.00000
   59    57    58    35.00000  117.00000
   53    49    50    69.00000  109.80000
   53    49    51    70.00000  112.02700
   55    53    54    33.00000  107.80000
   56    53    54    33.00000  107.80000
   56    53    55    33.00000  107.80000
   41    38    39    65.00000  118.96000
   43    41    42    35.00000  123.00000
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   0.00000  1.0 1.0
   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   1.00000 -1.0 2.0
   24    29    33    38   1.00000 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    38    39   7.00000 -1.0 2.0
   29    33    38    41   7.00000 -1.0 2.0
   33    38    39    40  -0.18600  1.0 3.0
   33    38    39    44   0.28850  1.0 1.0
   33    38    39    44   2.61350 -1.0 2.0
   33    38    39    44   0.78400  1.0 3.0
   33    38    41    42   1.00000 -1.0 2.0
   33    38    41    43  -0.79650  1.0 1.0
   33    38    41    43   1.60950 -1.0 2.0
   33    38    41    43  -0.26250  1.0 3.0
   34    33    38    39   7.00000 -1.0 2.0
   34    33    38    41   7.00000 -1.0 2.0
   38    39    44    45   7.00000 -1.0 2.0
   38    39    44    46   7.00000 -1.0 2.0
   39    38    41    42   1.00000 -1.0 2.0
   39    38    41    43  -0.79650  1.0 1.0
   39    38    41    43   1.60950 -1.0 2.0
   39    38    41    43  -0.26250  1.0 3.0
   39    44    46    47   0.09700  1.0 1.0
   39    44    46    47   0.15600 -1.0 2.0
   39    44    46    47  -0.50800  1.0 3.0
   39    44    46    48   0.00000  1.0 1.0
   39    44    46    49   0.09850  1.0 1.0
   39    44    46    49   0.15250 -1.0 2.0
   39    44    46    49  -0.50650  1.0 3.0
   40    39    44    45   7.00000 -1.0 2.0
   40    39    44    46   7.00000 -1.0 2.0
   44    46    49    50   0.56750  1.0 1.0
   44    46    49    50  -0.07550 -1.0 2.0
   44    46    49    50   0.20000  1.0 3.0
   44    46    49    51   0.31000  1.0 1.0
   44    46    49    51   0.14700 -1.0 2.0
   44    46    49    51   0.07550  1.0 3.0
   44    46    49    53   0.34400  1.0 1.0
   44    46    49    53   0.09450 -1.0 2.0
   44    46    49    53   0.11100  1.0 3.0
   45    44    46    47   0.00000  1.0 1.0
   45    44    46    48   0.33100  1.0 3.0
   45    44    46    49   0.00000  1.0 1.0
   46    49    51    52   0.00000  1.0 1.0
   46    49    51    57   0.09850  1.0 1.0
   46    49    51    57   0.15250 -1.0 2.0
   46    49    51    57  -0.50650  1.0 3.0
   46    49    53    54   0.15000  1.0 3.0
   46    49    53    55   0.15000  1.0 3.0
   46    49    53    56   0.15000  1.0 3.0
   47    46    49    50   0.22500  1.0 1.0
   47    46    49    51   0.56750  1.0 1.0
   47    46    49    51  -0.07550 -1.0 2.0
   47    46    49    51   0.20000  1.0 3.0
   47    46    49    53   0.35600  1.0 1.0
   47    46    49    53  -0.14650 -1.0 2.0
   47    46    49    53   0.33350  1.0 3.0
   48    46    49    50   0.27000  1.0 3.0
   48    46    49    51   0.15000  1.0 3.0
   48    46    49    53   0.15000  1.0 3.0
   49    51    57    58   7.00000 -1.0 2.0
   49    51    57    59   7.00000 -1.0 2.0
   50    49    51    52   0.00000  1.0 1.0
   50    49    51    57   0.09700  1.0 1.0
   50    49    51    57   0.15600 -1.0 2.0
   50    49    51    57  -0.50800  1.0 3.0
   50    49    53    54   0.27000  1.0 3.0
   50    49    53    55   0.27000  1.0 3.0
   50    49    53    56   0.27000  1.0 3.0
   51    49    53    54   0.15000  1.0 3.0
   51    49    53    55   0.15000  1.0 3.0
   51    49    53    56   0.15000  1.0 3.0
   52    51    57    58   7.00000 -1.0 2.0
   52    51    57    59   7.00000 -1.0 2.0
   53    49    51    52   0.00000  1.0 1.0
   53    49    51    57   0.09850  1.0 1.0
   53    49    51    57   0.15250 -1.0 2.0
   53    49    51    57  -0.50650  1.0 3.0
   41    38    39    40   0.00000  1.0 1.0
   41    38    39    44  -0.18600  1.0 3.0
IPHI
    9     5     7     8  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   37    30    35    36  10.50000 -1.0 2.0
   29    34    33    38  15.00000 -1.0 2.0
   39    41    38    33  15.00000 -1.0 2.0
   38    40    39    44  15.00000 -1.0 2.0
   46    45    44    39  15.00000 -1.0 2.0
   49    52    51    57  15.00000 -1.0 2.0
   58    59    57    51  15.00000 -1.0 2.0
   38    43    41    42  10.50000 -1.0 2.0
END
