* LIGAND DATABASE FILE (OPLS2005)
*
001      65    65    112    165     323
    1     0 S   NP   _N1_     1    28.86598    96.86707   -23.10349
    2     1 S   H    _HN1     2     1.02949    67.05678    13.80854
    3     1 S   H    _H1_     3     1.02828    43.35604   169.69662
    4     1 S   H    _H2_     4     1.02784   105.11660   -90.08836
    5     1 S   CT   _CA1     5     1.50106   140.72297   108.42553
    6     5 S   HC   _HA1     6     1.09572   105.19842    99.30930
    7     5 S   CO3  _C1_     7     1.53789   112.47553   -20.93937
    8     7 S   O2Z  _O11     8     1.26373   115.00649   -42.28830
    9     7 S   O2Z  _O12     9     1.26240   114.94945   136.87567
   10     5 S   CT   _CB1    10     1.53084   107.42985  -142.68753
   11    10 S   HC   HB11    11     1.09832   109.38768   -49.62690
   12    10 S   HC   HB12    12     1.09812   110.44544    66.99261
   13    10 S   CT   _CG1    13     1.52984   112.58958  -170.59414
   14    13 S   HC   HG11    14     1.09581   110.64231   -65.59315
   15    13 S   HC   HG12    15     1.09674   109.77223    53.62704
   16    13 S   C    _CD1    16     1.51803   112.24260   174.10778
   17    16 S   O    _OE1    17     1.22725   123.30547     7.36394
   18    16 S   N    _N2_    18     1.38657   111.62214  -172.71245
   19    18 S   H    _HN2    19     1.01578   118.93138     1.84207
   20    18 S   CT1  _CA2    20     1.46192   123.39831   177.51557
   21    20 S   HC   _HA2    21     1.09715   109.23968     7.24037
   22    20 S   C    _C2_    22     1.53702   109.84578  -108.69621
   23    22 S   O    _O2_    23     1.23118   121.88272  -158.17503
   24    20 S   CT   _CB2    32     1.53304   111.22578   129.18811
   25    24 S   HC   HB21    33     1.09547   109.76724    55.99022
   26    24 S   HC   HB22    34     1.09475   110.30165   174.94635
   27    22 S   N    _N3_    24     1.38135   114.34507    28.36992
   28    27 S   H    _HN3    25     1.01553   119.59108    -2.77305
   29    24 S   S    _SG2    35     1.82881   111.81121   -65.03344
   30    27 S   CT   _CA3    26     1.45266   123.26002   178.01574
   31    30 S   HC   HA31    27     1.09544   107.56936   -64.07602
   32    30 S   HC   HA32    28     1.09560   107.93950    52.38987
   33    29 S   CT   _C15    36     1.84102    99.54976   163.59844
   34    33 S   HC   _H3_    37     1.09643   106.84760   -53.99169
   35    30 S   CO3  _C3_    29     1.52955   114.01602   174.35236
   36    35 S   O2Z  _O31    30     1.26385   116.05105     0.75899
   37    35 S   O2Z  _O32    31     1.26422   114.42120  -179.19109
   38    33 S   C5A  _C14    38     1.49189   110.16511    65.23373
   39    33 S   CT   _C16    60     1.53156   108.43179  -171.33098
   40    39 S   HC   _H13    61     1.09841   110.16012    54.51682
   41    39 S   HC   _H14    62     1.09843   110.95697   -63.74800
   42    38 S   C5BC _C13    39     1.37973   134.44258    80.24285
   43    42 S   HA   _H12    40     1.08080   126.23747     0.36584
   44    39 S   CO3  _C17    63     1.53352   113.96286   173.17648
   45    44 S   O2Z  _O36    64     1.26194   116.14017   -33.96925
   46    44 S   O2Z  _O35    65     1.26425   114.42317   146.91661
   47    42 S   C5BC _C12    41     1.41527   106.45403  -179.64009
   48    47 S   HA   _H11    42     1.08099   127.24447   179.93744
   49    47 S   C5A  _C11    43     1.38020   106.62655     0.31153
   50    38 S   OA   _O34    44     1.36455   115.76912   -99.33768
   51    49 S   CO4  _C10    45     1.43989   131.27903   179.37442
   52    51 S   O    _O33    46     1.22598   123.68492     1.98080
   53    51 S   CZ   _C9_    47     1.44940   118.83396  -177.59068
   54    53 S   CZ   _C8_    48     1.20115   179.49837    55.62511
   55    54 S   CM   _C7_    49     1.42007   179.72094   152.32596
   56    55 S   HC   _H10    50     1.08618   117.16589    14.18756
   57    55 S   CM   _C6_    51     1.34073   124.04399  -165.82212
   58    57 S   HC   _H9_    52     1.08903   117.18335   179.64723
   59    57 S   CT   _C5_    53     1.50276   127.35948     0.33572
   60    59 S   HC   _H7_    54     1.09455   111.94795     3.88973
   61    59 S   HC   _H8_    55     1.09613   108.48426   121.39141
   62    59 S   CT   _C4_    56     1.52115   111.23760  -118.42233
   63    62 S   HC   _H4_    57     1.09527   111.32607   -57.77131
   64    62 S   HC   _H5_    58     1.09420   110.27527  -177.40173
   65    62 S   HC   _H6_    59     1.09525   111.08942    62.88639
  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   9   5   4   3
  13   7   2   1   1  11   7   4   3   6   4   2   1   1   6   3
   5   3   4   2   4   5   7   3   8   4   6   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    39    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    42    50    39    40    41    44  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    42    43    47    49    50    39    40    41    44    45    46  
   38    42    50    39    40    41    44  
   36    37  
   37  
    0  
   42    43    47    48    49    50    51    39    40    41    44  
   40    41    44    45    46    42    50  
   41    44    45    46  
   44    45    46  
   43    47    48    49    50    51  
   47    48    49    50  
   45    46  
   46  
    0  
   48    49    50    51    52    53  
   49    50    51  
   50    51    52    53    54  
   51    52    53  
   52    53    54    55  
   53    54  
   54    55    56    57  
   55    56    57    58    59  
   56    57    58    59    60    61    62  
   57    58    59  
   58    59    60    61    62    63    64    65  
   59    60    61    62  
   60    61    62    63    64    65  
   61    62    63    64    65  
   62    63    64    65  
   63    64    65  
   64    65  
   65  
    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   0.222500   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   3.5500   0.0700   0.008000   2.0020   1.7750   0.001000000  -0.843144165
   39   3.5000   0.0660  -0.220000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   42   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   43   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   44   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   47   3.5500   0.0760  -0.154000   2.0020   1.7750   0.001000000  -0.843144165
   48   2.4200   0.0300   0.126000   1.3810   1.2100   0.030040813   0.268726247
   49   3.5500   0.0700   0.008000   2.0020   1.7750   0.001000000  -0.843144165
   50   2.9000   0.1400  -0.190000   1.6450   1.4500   0.001000000  -0.126889456
   51   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   52   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   53   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   54   3.6500   0.1500   0.000000   2.0580   1.8250   0.025318638  -1.264311570
   55   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   56   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   57   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   58   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   59   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   60   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   61   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   62   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   63   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   64   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   65   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   340.000  1.090
   33    38   295.000  1.489
   33    39   268.000  1.529
   38    42   546.000  1.367
   38    50   340.000  1.360
   42    43   367.000  1.080
   42    47   469.000  1.424
   47    48   367.000  1.080
   47    49   546.000  1.367
   49    50   340.000  1.360
   49    51   335.000  1.450
   51    52   570.000  1.229
   51    53   335.000  1.469
   53    54   985.000  1.221
   54    55   400.000  1.423
   55    56   340.000  1.080
   55    57   549.000  1.340
   57    58   340.000  1.080
   57    59   317.000  1.510
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   268.000  1.529
   62    63   340.000  1.090
   62    64   340.000  1.090
   62    65   340.000  1.090
   39    40   340.000  1.090
   39    41   340.000  1.090
   39    44   317.000  1.522
   44    45   656.000  1.250
   44    46   656.000  1.250
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    80.00000  109.48900
   29    33    39    75.00000  111.63000
   33    38    42    50.00000  133.50000
   33    38    50    80.00000  116.10000
   33    39    40    37.50000  110.70000
   33    39    41    37.50000  110.70000
   33    39    44    70.00000  109.69300
   38    33    34    45.00000  110.47400
   38    42    43    35.00000  125.70000
   38    42    47    70.00000  107.30000
   38    50    49    70.00000  106.50000
   42    47    48    35.00000  127.50000
   42    47    49    70.00000  107.30000
   47    42    43    35.00000  127.50000
   47    49    50    70.00000  110.60000
   47    49    51    55.00000  130.80000
   49    47    48    35.00000  125.70000
   49    51    52    80.00000  122.40000
   49    51    53    65.00000  113.97000
   50    38    42    70.00000  110.60000
   51    49    50    80.00000  119.06000
   51    53    54    30.00000  178.16600
   53    51    52    80.00000  120.41200
   53    54    55    30.00000  178.29000
   54    55    56    40.00000  117.14900
   54    55    57    65.00000  121.28400
   55    57    58    35.00000  120.00000
   55    57    59    70.00000  124.00000
   57    55    56    35.00000  120.00000
   57    59    60    35.00000  109.50000
   57    59    61    35.00000  109.50000
   57    59    62    70.00000  112.02700
   59    57    58    35.00000  117.00000
   59    62    63    37.50000  110.70000
   59    62    64    37.50000  110.70000
   59    62    65    37.50000  110.70000
   61    59    60    33.00000  107.80000
   62    59    60    37.50000  110.70000
   62    59    61    37.50000  110.70000
   64    62    63    33.00000  107.80000
   65    62    63    33.00000  107.80000
   65    62    64    33.00000  107.80000
   39    33    34    37.50000  110.70000
   39    33    38    70.00000  113.44400
   39    44    45    70.00000  117.00000
   39    44    46    70.00000  117.00000
   41    39    40    33.00000  107.80000
   44    39    40    35.00000  109.50000
   44    39    41    35.00000  109.50000
   46    44    45    80.00000  126.00000
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  -0.23050  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   0.01700  1.0 1.0
   24    29    33    39  -0.23550 -1.0 2.0
   24    29    33    39   0.21350  1.0 3.0
   25    24    29    33   0.32350  1.0 3.0
   26    24    29    33   0.32350  1.0 3.0
   29    33    38    42  -0.16000  1.0 1.0
   29    33    38    42  -0.03200 -1.0 2.0
   29    33    38    42   0.04500  1.0 3.0
   29    33    38    50   0.04300 -1.0 2.0
   29    33    39    40   0.15000  1.0 3.0
   29    33    39    41   0.15000  1.0 3.0
   29    33    39    44   0.56750  1.0 1.0
   29    33    39    44  -0.07550 -1.0 2.0
   29    33    39    44   0.20000  1.0 3.0
   33    38    42    43   3.62500 -1.0 2.0
   33    38    42    47   3.62500 -1.0 2.0
   33    38    50    49   3.62500 -1.0 2.0
   33    39    44    45   0.41150 -1.0 2.0
   33    39    44    46   0.41150 -1.0 2.0
   34    33    38    42   0.00000  1.0 1.0
   34    33    38    50   0.00000  1.0 1.0
   34    33    39    40   0.15000  1.0 3.0
   34    33    39    41   0.15000  1.0 3.0
   34    33    39    44  -0.11250  1.0 3.0
   38    33    39    40   0.43200  1.0 3.0
   38    33    39    41   0.43200  1.0 3.0
   38    33    39    44  -2.95950  1.0 1.0
   38    33    39    44   0.02300  1.0 3.0
   38    42    47    48   3.62500 -1.0 2.0
   38    42   -47    49   3.62500 -1.0 2.0
   42    38   -50    49   3.62500 -1.0 2.0
   42    47   -49    50   3.62500 -1.0 2.0
   42    47    49    51   3.62500 -1.0 2.0
   43    42    47    48   3.62500 -1.0 2.0
   43    42    47    49   3.62500 -1.0 2.0
   47    49   -50    38   3.62500 -1.0 2.0
   47    49    51    52   1.05000 -1.0 2.0
   47    49    51    53   0.56600 -1.0 2.0
   48    47    49    50   3.62500 -1.0 2.0
   48    47    49    51   3.62500 -1.0 2.0
   49    51    53    54   0.00000  1.0 1.0
   50    38    42    43   3.62500 -1.0 2.0
   50    38   -42    47   3.62500 -1.0 2.0
   50    49    51    52   1.05000 -1.0 2.0
   50    49    51    53   0.56600 -1.0 2.0
   51    49    50    38   3.62500 -1.0 2.0
   51    53    54    55   0.00000  1.0 1.0
   52    51    53    54   0.00000  1.0 1.0
   53    54    55    56   0.00000  1.0 1.0
   53    54    55    57   0.00000  1.0 1.0
   54    55    57    58   7.00000 -1.0 2.0
   54    55    57    59   7.00000 -1.0 2.0
   55    57    59    60   0.00000  1.0 1.0
   55    57    59    61   0.00000  1.0 1.0
   55    57    59    62   0.09850  1.0 1.0
   55    57    59    62   0.15250 -1.0 2.0
   55    57    59    62  -0.50650  1.0 3.0
   56    55    57    58   7.00000 -1.0 2.0
   56    55    57    59   7.00000 -1.0 2.0
   57    59    62    63   0.15000  1.0 3.0
   57    59    62    64   0.15000  1.0 3.0
   57    59    62    65   0.15000  1.0 3.0
   58    57    59    60   0.33100  1.0 3.0
   58    57    59    61   0.33100  1.0 3.0
   58    57    59    62   0.00000  1.0 1.0
   60    59    62    63   0.15000  1.0 3.0
   60    59    62    64   0.15000  1.0 3.0
   60    59    62    65   0.15000  1.0 3.0
   61    59    62    63   0.15000  1.0 3.0
   61    59    62    64   0.15000  1.0 3.0
   61    59    62    65   0.15000  1.0 3.0
   39    33    38    42   0.04150 -1.0 2.0
   39    33    38    50   0.38650  1.0 1.0
   39    33    38    50  -0.24750 -1.0 2.0
   39    33    38    50   0.76750  1.0 3.0
   40    39    44    45   0.00000  1.0 1.0
   40    39    44    46   0.00000  1.0 1.0
   41    39    44    45   0.00000  1.0 1.0
   41    39    44    46   0.00000  1.0 1.0
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    38    33   4.00000 -1.0 2.0
   47    43    42    38   1.10000 -1.0 2.0
   49    48    47    42   1.10000 -1.0 2.0
   51    50    49    47   4.00000 -1.0 2.0
   49    53    51    52  10.50000 -1.0 2.0
   54    56    55    57  15.00000 -1.0 2.0
   59    58    57    55  15.00000 -1.0 2.0
   45    39    44    46  10.50000 -1.0 2.0
END
