* LIGAND DATABASE FILE (OPLS2005)
*
001      54    54     95    135     268
    1     0 S   NP   _N1_     1    29.05276    96.45316   -22.95252
    2     1 S   H    _HN1     2     1.02801   107.21802  -102.96419
    3     1 S   H    _H1_     3     1.02946    71.64228     1.15606
    4     1 S   H    _H2_     4     1.02830    37.89526   159.89975
    5     1 S   CT   _CA1     5     1.50109   136.90623   101.78727
    6     5 S   HC   _HA1     6     1.09577   105.18571    93.28922
    7     5 S   CO3  _C1_     7     1.53760   112.33835   -26.92730
    8     7 S   O2Z  _O11     8     1.26361   115.04666   -46.62957
    9     7 S   O2Z  _O12     9     1.26225   114.92334   132.33693
   10     5 S   CT   _CB1    10     1.53047   107.38924  -148.83029
   11    10 S   HC   HB11    11     1.09844   109.36967   -49.91023
   12    10 S   HC   HB12    12     1.09808   110.48368    66.67178
   13    10 S   CT   _CG1    13     1.53009   112.60665  -170.82502
   14    13 S   HC   HG11    14     1.09543   110.67675   -67.20061
   15    13 S   HC   HG12    15     1.09654   109.72835    52.07516
   16    13 S   C    _CD1    16     1.51771   111.81694   172.85501
   17    16 S   O    _OE1    17     1.22768   123.05338    16.44341
   18    16 S   N    _N2_    18     1.38580   111.97969  -163.94372
   19    18 S   H    _HN2    19     1.01600   119.15454     1.42478
   20    18 S   CT1  _CA2    20     1.46328   123.38009   177.60028
   21    20 S   HC   _HA2    21     1.09729   109.26941     8.74110
   22    20 S   C    _C2_    22     1.53679   109.10066  -106.93928
   23    22 S   O    _O2_    23     1.23089   122.20183  -150.66689
   24    20 S   CT   _CB2    32     1.53302   111.28959   130.67466
   25    24 S   HC   HB21    33     1.09419   109.35784    58.98030
   26    24 S   HC   HB22    34     1.09532   110.55229   176.95811
   27    22 S   N    _N3_    24     1.38303   113.95331    36.84355
   28    27 S   H    _HN3    25     1.01527   119.59219    -3.27913
   29    24 S   S    _SG2    35     1.83490   111.00978   -64.19150
   30    27 S   CT   _CA3    26     1.45267   123.32599   177.26956
   31    30 S   HC   HA31    27     1.09546   107.52190   -64.71759
   32    30 S   HC   HA32    28     1.09554   107.99473    51.74953
   33    29 S   CT   _C9_    36     1.87025   101.60048   141.80576
   34    33 S   OM   _O33    37     1.31570   109.21933    61.27645
   35    30 S   CO3  _C3_    29     1.52984   114.02042   173.74004
   36    35 S   O2Z  _O31    30     1.26389   116.08836    -0.39366
   37    35 S   O2Z  _O32    31     1.26428   114.41208   179.65736
   38    33 S   C5A  _C8_    38     1.51475   109.91785   -62.11677
   39    33 S   S    _S1_    50     1.86967   105.99396   179.07001
   40    38 S   C5BC _C7_    39     1.38833   132.65860   125.60199
   41    40 S   HA   _H7_    40     1.08168   125.48468     0.15702
   42    39 S   CT   _C10    51     1.81533   101.41353   177.42808
   43    42 S   HC   _H9_    52     1.09373   108.47200   177.62480
   44    42 S   HC   _H10    53     1.09267   111.31683    59.01331
   45    42 S   HC   _H11    54     1.09248   111.07999   -64.01701
   46    40 S   C5BC _C6_    41     1.41524   108.33834  -179.47848
   47    46 S   HA   _H6_    42     1.08125   126.72870   179.65170
   48    46 S   C5A  _C5_    43     1.37775   107.56981    -0.30067
   49    38 S   NA   _N4_    44     1.38292   121.38592   -54.43945
   50    49 S   H    _H8_    45     1.01083   123.97167     0.01978
   51    48 S   CT   _C4_    46     1.48153   130.78978   179.64173
   52    51 S   HC   _H3_    47     1.09473   111.41001   155.71690
   53    51 S   HC   _H4_    48     1.09438   110.14768   -83.93751
   54    51 S   HC   _H5_    49     1.09467   110.68032    35.71365
  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   7   5   4   3
  13   5   2   1   1  10   6   7   4   3   2   1   1   8   3   6
   5   1   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    40    49    39    42  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    40    41    46    48    49    50    39    42    43    44    45  
   38    40    49    39    42  
   36    37  
   37  
    0  
   40    41    46    47    48    49    50    51    39    42  
   42    43    44    45    40    49  
   41    46    47    48    49    50    51  
   46    47    48    49  
   43    44    45  
   44    45  
   45  
    0  
   47    48    49    50    51    52    53    54  
   48    49    51  
   49    50    51    52    53    54  
   50    51    52    53    54  
   51  
   52    53    54  
   53    54  
   54  
    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   4.2000   0.3000   0.110000   1.9750   1.7500   0.005000000  -0.741685710
   34   3.1500   0.2500  -0.980000   1.7825   1.5750   0.001000000  -0.126889456
   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   0.0700  -0.123000   2.0020   1.7750   0.001000000  -0.843144165
   39   3.6000   0.3550  -0.175000   2.0300   1.8000   0.025682759  -1.666211680
   40   3.5500   0.0700  -0.149000   2.0020   1.7750   0.001000000  -0.843144165
   41   2.4200   0.0300   0.118000   1.3810   1.2100   0.030040813   0.268726247
   42   3.5000   0.0660  -0.012500   1.9750   1.7500   0.005000000  -0.741685710
   43   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   44   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   45   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   46   3.5500   0.0700  -0.149000   2.0020   1.7750   0.001000000  -0.843144165
   47   2.4200   0.0300   0.118000   1.3810   1.2100   0.030040813   0.268726247
   48   3.5500   0.0700  -0.163000   2.0020   1.7750   0.001000000  -0.843144165
   49   3.2500   0.1700  -0.239000   1.8650   1.6500   0.001000000  -0.511443539
   50   0.5000   0.0300   0.317000   0.9960   0.8600   0.030040813  -0.651083722
   51   3.5000   0.0660  -0.025000   1.9750   1.7500   0.005000000  -0.741685710
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   54   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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   570.000  1.307
   33    38   295.000  1.489
   33    39   222.000  1.810
   38    40   546.000  1.367
   38    49   427.000  1.381
   40    41   367.000  1.080
   40    46   469.000  1.424
   46    47   367.000  1.080
   46    48   546.000  1.367
   48    49   427.000  1.381
   48    51   295.000  1.489
   49    50   434.000  1.010
   51    52   340.000  1.090
   51    53   340.000  1.090
   51    54   340.000  1.090
   39    42   222.000  1.810
   42    43   340.000  1.090
   42    44   340.000  1.090
   42    45   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    85.00000  114.68000
   29    33    38    80.00000  109.48900
   29    33    39    75.00000  118.28000
   33    38    40    50.00000  133.50000
   33    38    49    65.00000  122.56900
   33    39    42    62.00000   98.90000
   38    33    34    90.00000  106.80000
   38    40    41    35.00000  125.70000
   38    40    46    70.00000  107.30000
   38    49    48    70.00000  109.80000
   38    49    50    35.00000  120.00000
   40    46    47    35.00000  127.50000
   40    46    48    70.00000  107.30000
   46    40    41    35.00000  127.50000
   46    48    49    70.00000  107.70000
   46    48    51    50.00000  133.50000
   48    46    47    35.00000  125.70000
   48    49    50    35.00000  120.00000
   48    51    52    45.00000  110.47400
   48    51    53    45.00000  110.47400
   48    51    54    45.00000  110.47400
   49    38    40    70.00000  107.70000
   51    48    49    65.00000  122.56900
   53    51    52    33.00000  107.80000
   54    51    52    33.00000  107.80000
   54    51    53    33.00000  107.80000
   39    33    34    85.00000  114.68000
   39    33    38    80.00000  109.48900
   39    42    43    35.00000  109.50000
   39    42    44    35.00000  109.50000
   39    42    45    35.00000  109.50000
   44    42    43    33.00000  107.80000
   45    42    43    33.00000  107.80000
   45    42    44    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   0.13850  1.0 1.0
   24    29    33    34  -1.34450 -1.0 2.0
   24    29    33    34   0.57400  1.0 3.0
   24    29    33    38  -0.23050  1.0 1.0
   24    29    33    38   0.06200 -1.0 2.0
   24    29    33    38   0.47200  1.0 3.0
   24    29    33    39   0.08500  1.0 1.0
   24    29    33    39  -0.53150 -1.0 2.0
   24    29    33    39   0.48050  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    40  -0.16000  1.0 1.0
   29    33    38    40  -0.03200 -1.0 2.0
   29    33    38    40   0.04500  1.0 3.0
   29    33    38    49   0.04300 -1.0 2.0
   29    33    39    42   0.08500  1.0 1.0
   29    33    39    42  -0.53150 -1.0 2.0
   29    33    39    42   0.48050  1.0 3.0
   33    38    40    41   3.62500 -1.0 2.0
   33    38    40    46   3.62500 -1.0 2.0
   33    38    49    48   3.62500 -1.0 2.0
   33    38    49    50   2.00000 -1.0 2.0
   33    39    42    43   0.32350  1.0 3.0
   33    39    42    44   0.32350  1.0 3.0
   33    39    42    45   0.32350  1.0 3.0
   34    33    38    40   0.64500  1.0 1.0
   34    33    38    40   0.14800 -1.0 2.0
   34    33    38    40   0.20650  1.0 3.0
   34    33    38    49   0.04300 -1.0 2.0
   34    33    39    42   0.13850  1.0 1.0
   34    33    39    42  -1.34450 -1.0 2.0
   34    33    39    42   0.57400  1.0 3.0
   38    33    39    42  -0.23050  1.0 1.0
   38    33    39    42   0.06200 -1.0 2.0
   38    33    39    42   0.47200  1.0 3.0
   38    40    46    47   3.62500 -1.0 2.0
   38    40   -46    48   3.62500 -1.0 2.0
   40    38   -49    48   3.62500 -1.0 2.0
   40    38    49    50   2.00000 -1.0 2.0
   40    46   -48    49   3.62500 -1.0 2.0
   40    46    48    51   3.62500 -1.0 2.0
   41    40    46    47   3.62500 -1.0 2.0
   41    40    46    48   3.62500 -1.0 2.0
   46    48   -49    38   3.62500 -1.0 2.0
   46    48    49    50   2.00000 -1.0 2.0
   46    48    51    52   0.00000  1.0 1.0
   46    48    51    53   0.00000  1.0 1.0
   46    48    51    54   0.00000  1.0 1.0
   47    46    48    49   3.62500 -1.0 2.0
   47    46    48    51   3.62500 -1.0 2.0
   49    38    40    41   3.62500 -1.0 2.0
   49    38   -40    46   3.62500 -1.0 2.0
   49    48    51    52   0.00000  1.0 1.0
   49    48    51    53   0.00000  1.0 1.0
   49    48    51    54   0.00000  1.0 1.0
   51    48    49    38   3.62500 -1.0 2.0
   51    48    49    50   2.00000 -1.0 2.0
   39    33    38    40  -0.16000  1.0 1.0
   39    33    38    40  -0.03200 -1.0 2.0
   39    33    38    40   0.04500  1.0 3.0
   39    33    38    49   0.04300 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   40    49    38    33   4.00000 -1.0 2.0
   46    41    40    38   1.10000 -1.0 2.0
   48    47    46    40   1.10000 -1.0 2.0
   51    49    48    46   4.00000 -1.0 2.0
   50    38    49    48   1.00000 -1.0 2.0
END
