* LIGAND DATABASE FILE (OPLS2005)
*
001      72    73    133    206     380
    1     0 S   NP   _N1_     1    29.33437    93.49015   -18.61087
    2     1 S   H    _HN1     2     1.02959   112.20598    36.11192
    3     1 S   H    _H1_     3     1.02846    36.36755   125.02413
    4     1 S   H    _H2_     4     1.02786    72.17197   -66.86988
    5     1 S   CT   _CA1     5     1.50079   132.64778  -170.96673
    6     5 S   HC   _HA1     6     1.09557   105.37580    24.74624
    7     5 S   CO3  _C1_     7     1.53964   112.11828   -95.83574
    8     7 S   O2Z  _O11     8     1.26380   115.07880   -48.57050
    9     7 S   O2Z  _O12     9     1.26228   114.92491   130.68968
   10     5 S   CT   _CB1    10     1.53082   107.46798   142.90342
   11    10 S   HC   HB11    11     1.09817   109.85924   -48.00793
   12    10 S   HC   HB12    12     1.09842   110.14715    68.53587
   13    10 S   CT   _CG1    13     1.53116   112.60909  -169.06148
   14    13 S   HC   HG11    14     1.09485   110.43949   -49.65292
   15    13 S   HC   HG12    15     1.09572   110.41262    69.32438
   16    13 S   C    _CD1    16     1.51751   111.08447  -170.77197
   17    16 S   O    _OE1    17     1.22793   122.65530   -30.48471
   18    16 S   N    _N2_    18     1.38495   112.25667   149.84502
   19    18 S   H    _HN2    19     1.01577   119.23561     3.31671
   20    18 S   CT1  _CA2    20     1.46219   123.31455  -173.87958
   21    20 S   HC   _HA2    21     1.09724   109.37515   -17.65473
   22    20 S   C    _C2_    22     1.53324   108.33044  -133.61896
   23    22 S   O    _O2_    23     1.22999   122.30859  -145.26496
   24    20 S   CT   _CB2    32     1.53514   111.07404   104.31360
   25    24 S   HC   HB21    33     1.09574   109.82016    55.97247
   26    24 S   HC   HB22    34     1.09524   110.63754   174.19157
   27    22 S   N    _N3_    24     1.38526   113.27392    42.09245
   28    27 S   H    _HN3    25     1.01536   118.91791    -0.47601
   29    24 S   S    _SG2    35     1.82525   111.92837   -66.11981
   30    27 S   CT   _CA3    26     1.45440   123.35682   175.04920
   31    30 S   HC   HA31    27     1.09530   109.12367    26.43898
   32    30 S   HC   HA32    28     1.09492   107.14775   143.43722
   33    29 S   C3T  _C8_    36     1.75065   102.51616   149.05167
   34    33 S   Cl   Cl1_    37     1.79485   111.23149    67.50172
   35    30 S   CO3  _C3_    29     1.52937   113.21008   -96.94964
   36    35 S   O2Z  _O31    30     1.26394   115.45638   -43.08468
   37    35 S   O2Z  _O32    31     1.26362   114.94560   137.85930
   38    33 S   C3T  _C7_    38     1.51532   122.75563   -74.05954
   39    38 S   HC   _H3_    39     1.08816   116.44251   141.92087
   40    33 S   C3T  _C6_    40     1.55332   121.37669  -146.33659
   41    38 S   CT   _C9_    69     1.49162   124.50771     1.44645
   42    41 S   HC   _H10    70     1.09103   113.98664   -32.60457
   43    41 S   HC   _H11    71     1.09482   109.73879  -153.54066
   44    41 S   HC   _H12    72     1.09478   109.87451    88.23794
   45    40 S   C    _C10    41     1.51248   118.06522  -143.07524
   46    45 S   O    _O33    42     1.22571   120.39083    60.56635
   47    40 S   CT   _C5_    62     1.53175   120.38728     5.70492
   48    47 S   HC   _H8_    63     1.09359   112.34430    32.19878
   49    47 S   HC   _H9_    64     1.09698   108.50385   149.15770
   50    45 S   N    _N4_    43     1.38261   113.79185  -121.20506
   51    50 S   H    _H13    44     1.01520   119.02653     1.52842
   52    47 S   CT   _C4_    65     1.52268   112.65334   -90.11417
   53    52 S   HC   _H5_    66     1.09438   111.38163   -64.52487
   54    52 S   HC   _H6_    67     1.09465   110.12252   176.15188
   55    52 S   HC   _H7_    68     1.09417   111.40496    56.03257
   56    50 S   CT   _C11    45     1.45829   122.68393   175.79616
   57    56 S   HC   _H4_    46     1.09746   107.15507    32.17665
   58    56 S   CA   _C13    47     1.51675   110.40397   -86.32408
   59    56 S   CT   _C12    58     1.52824   110.55940   148.98714
   60    59 S   HC   _H14    59     1.09576   112.02907    59.57238
   61    59 S   HC   _H15    60     1.09543   111.05959  -179.67254
   62    59 S   HC   _H16    61     1.09576   110.44472   -59.76971
   63    58 S   CA   _C14    48     1.40331   119.92446   117.08838
   64    63 S   HA   _H17    49     1.08759   120.38914     0.48457
   65    63 S   CA   _C15    50     1.39638   120.72732  -179.22696
   66    65 S   HA   _H18    51     1.08670   119.37179   179.96044
   67    65 S   CA   _C16    52     1.39321   119.73046     0.12033
   68    67 S   Cl   Cl2_    53     1.72176   119.79224   179.92598
   69    67 S   CA   _C17    54     1.39319   120.42400     0.05234
   70    69 S   HA   _H19    55     1.08667   120.89057   179.79633
   71    58 S   CA   _C18    56     1.40430   121.38939   -61.83136
   72    71 S   HA   _H20    57     1.08729   120.44574    -0.42290
  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   8   5   4   3
  15   6   2   1   1  13   7  16   5   2   1   1  11   4   7   5
   4  10   4   3   2   1   1  12   7  13   5   2   1   1   8   4
   6   3   5   3   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    40    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    40    45    47    41  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    40    45    46    50    47    48    49    52    41    42    43    44  
   38    39    40    45    47    41  
   36    37  
   37  
    0  
   39    40    45    46    50    47    48    49    52    41    42    43    44  
   40    45    47    41    42    43    44  
   45    46    50    51    56    47    48    49    52    53    54    55    41    42    43    44  
   42    43    44    45    47  
   43    44  
   44  
    0  
   46    50    51    56    57    58    59    47    48    49    52  
   50    51    56    47  
   48    49    52    53    54    55    50  
   49    52    53    54    55  
   52    53    54    55  
   51    56    57    58    63    71    59    60    61    62  
   56    57    58    59  
   53    54    55  
   54    55  
   55  
    0  
   57    58    63    64    65    69    71    72    59    60    61    62  
   58    63    71    59    60    61    62  
   63    64    65    66    67    69    70    71    72    59    60    61    62  
   60    61    62    63    71  
   61    62  
   62  
    0  
   64    65    66    67    68    69    71    72  
   65    66    67    71  
   66    67    68    69    70    71  
   67    68    69  
   68    69    70    71    72  
   69    70    71  
   70    71    72  
   71    72  
   72  
    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   3.5000   0.0660   0.228500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.4000   0.3000  -0.221000   2.1950   1.9500   0.001000000   0.320982824
   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  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   39   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   40   3.5000   0.0660   0.000000   1.9750   1.7500   0.005000000  -0.741685710
   41   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   42   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   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   3.7500   0.1050   0.500000   1.9250   1.7000   0.001000000  -0.126889456
   46   2.9600   0.2100  -0.500000   1.5250   1.4250   0.001000000  -1.480495490
   47   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.2500   0.1700  -0.500000   1.8100   1.6000   0.054801302  -1.445846770
   51   0.5000   0.0300   0.300000   1.5900   1.4000   0.030040813  -0.651083722
   52   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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
   55   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   56   3.5000   0.0660   0.255000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.3810   1.2100   0.008598240   0.268726247
   58   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   59   3.5000   0.0660  -0.180000   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   63   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   64   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   65   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   66   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   67   3.5500   0.0700   0.180000   2.5000   1.7750   0.001000000  -0.843144165
   68   3.4000   0.3000  -0.180000   2.1950   1.9500   0.001000000   0.320982824
   69   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   70   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   71   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   72   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   220.000  1.750
   33    38   260.000  1.509
   33    40   260.000  1.509
   38    39   340.000  1.088
   38    40   260.000  1.509
   38    41   275.000  1.510
   40    45   295.000  1.481
   40    47   275.000  1.510
   45    46   570.000  1.229
   45    50   490.000  1.335
   50    51   434.000  1.010
   50    56   337.000  1.449
   56    57   340.000  1.090
   56    58   317.000  1.510
   56    59   268.000  1.529
   58    63   469.000  1.400
   58    71   469.000  1.400
   63    64   367.000  1.080
   63    65   469.000  1.400
   65    66   367.000  1.080
   65    67   469.000  1.400
   67    68   300.000  1.725
   67    69   469.000  1.400
   69    70   367.000  1.080
   69    71   469.000  1.400
   71    72   367.000  1.080
   59    60   340.000  1.090
   59    61   340.000  1.090
   59    62   340.000  1.090
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    52   268.000  1.529
   52    53   340.000  1.090
   52    54   340.000  1.090
   52    55   340.000  1.090
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    44   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  110.65400
   29    33    38    75.00000  111.63000
   29    33    40    75.00000  111.63000
   33    38    39    37.50000  117.20000
   33    38    40    10.00000   60.00500
   33    38    41    60.00000  120.94000
   33    40    38    10.00000   60.00500
   33    40    45    65.00000  116.19300
   33    40    47    60.00000  120.94000
   38    33    34    65.00000  117.97100
   38    40    45    65.00000  116.19300
   38    40    47    60.00000  120.94000
   38    41    42    45.00000  109.38400
   38    41    43    45.00000  109.38400
   38    41    44    45.00000  109.38400
   40    33    34    65.00000  117.97100
   40    33    38    10.00000   60.00500
   40    38    39    37.50000  117.20000
   40    45    46    75.00000  122.66600
   40    45    50    75.00000  114.51300
   40    47    48    45.00000  109.38400
   40    47    49    45.00000  109.38400
   40    47    52    70.00000  112.37300
   45    50    51    35.00000  119.80000
   45    50    56    50.00000  121.90000
   50    45    46    80.00000  122.90000
   50    56    57    35.00000  109.50000
   50    56    58    75.00000  111.96400
   50    56    59    70.00000  110.72300
   56    50    51    38.00000  118.40000
   56    58    63    70.00000  120.00000
   56    58    71    70.00000  120.00000
   56    59    60    37.50000  110.70000
   56    59    61    37.50000  110.70000
   56    59    62    37.50000  110.70000
   58    56    57    35.00000  109.50000
   58    63    64    35.00000  120.00000
   58    63    65    63.00000  120.00000
   58    71    69    63.00000  120.00000
   58    71    72    35.00000  120.00000
   63    65    66    35.00000  120.00000
   63    65    67    63.00000  120.00000
   65    63    64    35.00000  120.00000
   65    67    68    75.00000  120.00000
   65    67    69    63.00000  120.00000
   67    65    66    35.00000  120.00000
   67    69    70    35.00000  120.00000
   67    69    71    63.00000  120.00000
   69    67    68    75.00000  120.00000
   69    71    72    35.00000  120.00000
   71    58    63    63.00000  120.00000
   71    69    70    35.00000  120.00000
   59    56    57    37.50000  110.70000
   59    56    58    70.00000  112.17500
   61    59    60    33.00000  107.80000
   62    59    60    33.00000  107.80000
   62    59    61    33.00000  107.80000
   47    40    45    63.00000  111.10000
   47    52    53    37.50000  110.70000
   47    52    54    37.50000  110.70000
   47    52    55    37.50000  110.70000
   49    47    48    33.00000  107.80000
   52    47    48    37.50000  110.70000
   52    47    49    37.50000  110.70000
   54    52    53    33.00000  107.80000
   55    52    53    33.00000  107.80000
   55    52    54    33.00000  107.80000
   41    38    39    40.00000  115.04500
   41    38    40    60.00000  120.94000
   43    41    42    33.00000  107.80000
   44    41    42    33.00000  107.80000
   44    41    43    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   0.01700  1.0 1.0
   24    29    33    34  -0.23550 -1.0 2.0
   24    29    33    34   0.21350  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    40   0.44750  1.0 1.0
   29    33   -38    40  -0.17800 -1.0 2.0
   29    33   -38    40   0.20200  1.0 3.0
   29    33    38    41   0.44750  1.0 1.0
   29    33    38    41  -0.17800 -1.0 2.0
   29    33    38    41   0.20200  1.0 3.0
   29    33   -40    38   0.44750  1.0 1.0
   29    33   -40    38  -0.17800 -1.0 2.0
   29    33   -40    38   0.20200  1.0 3.0
   29    33    40    45   0.56750  1.0 1.0
   29    33    40    45  -0.07550 -1.0 2.0
   29    33    40    45   0.20000  1.0 3.0
   29    33    40    47   0.44750  1.0 1.0
   29    33    40    47  -0.17800 -1.0 2.0
   29    33    40    47   0.20200  1.0 3.0
   33    38   -40    45  -0.95700  1.0 1.0
   33    38   -40    45  -0.18200 -1.0 2.0
   33    38   -40    45   0.29450  1.0 3.0
   33    38   -40    47   0.07850  1.0 1.0
   33    38   -40    47  -0.03950 -1.0 2.0
   33    38   -40    47   0.67350  1.0 3.0
   33    38    41    42   0.15000  1.0 3.0
   33    38    41    43   0.15000  1.0 3.0
   33    38    41    44   0.15000  1.0 3.0
   33    40    45    46   0.30150 -1.0 2.0
   33    40    45    50   1.39750  1.0 1.0
   33    40    45    50  -0.07950 -1.0 2.0
   33    40    45    50  -0.18750  1.0 3.0
   33    40    47    48   0.15000  1.0 3.0
   33    40    47    49   0.15000  1.0 3.0
   33    40    47    52   0.07850  1.0 1.0
   33    40    47    52  -0.03950 -1.0 2.0
   33    40    47    52   0.67350  1.0 3.0
   34    33    38    39   0.27000  1.0 3.0
   34    33   -38    40   0.35600  1.0 1.0
   34    33   -38    40  -0.14650 -1.0 2.0
   34    33   -38    40   0.33350  1.0 3.0
   34    33    38    41   0.35600  1.0 1.0
   34    33    38    41  -0.14650 -1.0 2.0
   34    33    38    41   0.33350  1.0 3.0
   34    33   -40    38   0.35600  1.0 1.0
   34    33   -40    38  -0.14650 -1.0 2.0
   34    33   -40    38   0.33350  1.0 3.0
   34    33    40    45   0.56750  1.0 1.0
   34    33    40    45  -0.07550 -1.0 2.0
   34    33    40    45   0.20000  1.0 3.0
   34    33    40    47   0.35600  1.0 1.0
   34    33    40    47  -0.14650 -1.0 2.0
   34    33    40    47   0.33350  1.0 3.0
   38    33   -40    45  -0.95700  1.0 1.0
   38    33   -40    45  -0.18200 -1.0 2.0
   38    33   -40    45   0.29450  1.0 3.0
   38    33   -40    47   0.07850  1.0 1.0
   38    33   -40    47  -0.03950 -1.0 2.0
   38    33   -40    47   0.67350  1.0 3.0
   38    40    45    46   0.30150 -1.0 2.0
   38    40    45    50   1.39750  1.0 1.0
   38    40    45    50  -0.07950 -1.0 2.0
   38    40    45    50  -0.18750  1.0 3.0
   38    40    47    48   0.15000  1.0 3.0
   38    40    47    49   0.15000  1.0 3.0
   38    40    47    52   0.07850  1.0 1.0
   38    40    47    52  -0.03950 -1.0 2.0
   38    40    47    52   0.67350  1.0 3.0
   39    38   -40    33   0.15000  1.0 3.0
   39    38    40    45  -0.11250  1.0 3.0
   39    38    40    47   0.15000  1.0 3.0
   39    38    41    42   0.15000  1.0 3.0
   39    38    41    43   0.15000  1.0 3.0
   39    38    41    44   0.15000  1.0 3.0
   40    33   -38    39   0.15000  1.0 3.0
   40    33   -38    41   0.07850  1.0 1.0
   40    33   -38    41  -0.03950 -1.0 2.0
   40    33   -38    41   0.67350  1.0 3.0
   40    38    41    42   0.15000  1.0 3.0
   40    38    41    43   0.15000  1.0 3.0
   40    38    41    44   0.15000  1.0 3.0
   40    45    50    51   2.45000 -1.0 2.0
   40    45    50    56   1.49850  1.0 1.0
   40    45    50    56   1.53950 -1.0 2.0
   40    47    52    53   0.15000  1.0 3.0
   40    47    52    54   0.15000  1.0 3.0
   40    47    52    55   0.15000  1.0 3.0
   45    40    47    48  -0.11250  1.0 3.0
   45    40    47    49  -0.11250  1.0 3.0
   45    40    47    52  -0.95700  1.0 1.0
   45    40    47    52  -0.18200 -1.0 2.0
   45    40    47    52   0.29450  1.0 3.0
   45    50    56    57   0.00000  1.0 1.0
   45    50    56    58  -0.69800  1.0 1.0
   45    50    56    58  -0.21350 -1.0 2.0
   45    50    56    59  -0.43950  1.0 1.0
   45    50    56    59  -0.08100 -1.0 2.0
   45    50    56    59   0.03350  1.0 3.0
   46    45    50    51   2.45000 -1.0 2.0
   46    45    50    56   3.04450 -1.0 2.0
   50    56    58    63  -0.24500  1.0 1.0
   50    56    58    63   0.48300 -1.0 2.0
   50    56    58    63   0.08900  1.0 3.0
   50    56    58    71  -0.24500  1.0 1.0
   50    56    58    71   0.48300 -1.0 2.0
   50    56    58    71   0.08900  1.0 3.0
   50    56    59    60   0.15000  1.0 3.0
   50    56    59    61   0.15000  1.0 3.0
   50    56    59    62   0.15000  1.0 3.0
   51    50    56    57   0.00000  1.0 1.0
   51    50    56    58   0.00000  1.0 1.0
   51    50    56    59   0.00000  1.0 1.0
   56    58    63    64   3.62500 -1.0 2.0
   56    58    63    65   3.62500 -1.0 2.0
   56    58    71    69   3.62500 -1.0 2.0
   56    58    71    72   3.62500 -1.0 2.0
   57    56    58    63   0.00000  1.0 1.0
   57    56    58    71   0.00000  1.0 1.0
   57    56    59    60   0.15000  1.0 3.0
   57    56    59    61   0.15000  1.0 3.0
   57    56    59    62   0.15000  1.0 3.0
   58    56    59    60   0.43200  1.0 3.0
   58    56    59    61   0.43200  1.0 3.0
   58    56    59    62   0.43200  1.0 3.0
   58    63    65    66   3.62500 -1.0 2.0
   58    63    65    67   3.62500 -1.0 2.0
   63    58    71    69   3.62500 -1.0 2.0
   63    58    71    72   3.62500 -1.0 2.0
   63    65    67    68   3.62500 -1.0 2.0
   63    65   -67    69   3.62500 -1.0 2.0
   64    63    65    66   3.62500 -1.0 2.0
   64    63    65    67   3.62500 -1.0 2.0
   65    67    69    70   3.62500 -1.0 2.0
   65    67    69    71   3.62500 -1.0 2.0
   66    65    67    68   3.62500 -1.0 2.0
   66    65    67    69   3.62500 -1.0 2.0
   67    69   -71    58   3.62500 -1.0 2.0
   67    69    71    72   3.62500 -1.0 2.0
   68    67    69    70   3.62500 -1.0 2.0
   68    67    69    71   3.62500 -1.0 2.0
   70    69    71    58   3.62500 -1.0 2.0
   70    69    71    72   3.62500 -1.0 2.0
   71    58    63    64   3.62500 -1.0 2.0
   71    58   -63    65   3.62500 -1.0 2.0
   59    56    58    63   0.04150 -1.0 2.0
   59    56    58    71   0.04150 -1.0 2.0
   47    40    45    46   0.30150 -1.0 2.0
   47    40    45    50   1.39750  1.0 1.0
   47    40    45    50  -0.07950 -1.0 2.0
   47    40    45    50  -0.18750  1.0 3.0
   48    47    52    53   0.15000  1.0 3.0
   48    47    52    54   0.15000  1.0 3.0
   48    47    52    55   0.15000  1.0 3.0
   49    47    52    53   0.15000  1.0 3.0
   49    47    52    54   0.15000  1.0 3.0
   49    47    52    55   0.15000  1.0 3.0
   41    38   -40    33   0.07850  1.0 1.0
   41    38   -40    33  -0.03950 -1.0 2.0
   41    38   -40    33   0.67350  1.0 3.0
   41    38    40    45  -0.95700  1.0 1.0
   41    38    40    45  -0.18200 -1.0 2.0
   41    38    40    45   0.29450  1.0 3.0
   41    38    40    47   0.56750  1.0 1.0
   41    38    40    47  -0.07550 -1.0 2.0
   41    38    40    47   0.20000  1.0 3.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   40    50    45    46  10.50000 -1.0 2.0
   51    45    50    56   1.00000 -1.0 2.0
   63    71    58    56   4.00000 -1.0 2.0
   65    64    63    58   1.10000 -1.0 2.0
   67    66    65    63   1.10000 -1.0 2.0
   69    68    67    65   4.00000 -1.0 2.0
   71    70    69    67   1.10000 -1.0 2.0
   69    72    71    58   1.10000 -1.0 2.0
END
