* LIGAND DATABASE FILE (OPLS2005)
*
001     115   116    217    330     641
    1     0 S   NP   _N1_     1    28.67434    96.36306   -21.85994
    2     1 S   H    _HN1     2     1.02955    75.17171    23.52599
    3     1 S   H    _H1_     3     1.02789    40.80917   164.30435
    4     1 S   H    _H2_     4     1.02782    94.95971   -84.13714
    5     1 S   CT   _CA1     5     1.50084   147.52411   128.35697
    6     5 S   HC   _HA1     6     1.09576   105.17300    81.54814
    7     5 S   CO3  _C1_     7     1.53832   112.45125   -38.68176
    8     7 S   O2Z  _O11     8     1.26353   115.03252   -45.86602
    9     7 S   O2Z  _O12     9     1.26238   114.94242   133.22649
   10     5 S   CT   _CB1    10     1.53060   107.30166  -160.69601
   11    10 S   HC   HB11    11     1.09828   109.38433   -49.93711
   12    10 S   HC   HB12    12     1.09810   110.49530    66.69672
   13    10 S   CT   _CG1    13     1.52904   112.52628  -170.89696
   14    13 S   HC   HG11    14     1.09524   110.43199   -65.18562
   15    13 S   HC   HG12    15     1.09662   109.93912    54.02066
   16    13 S   C    _CD1    16     1.51775   112.30584   174.50296
   17    16 S   O    _OE1    17     1.22718   123.34548     3.09092
   18    16 S   N    _N2_    18     1.38577   111.55085  -177.01181
   19    18 S   H    _HN2    19     1.01544   118.90959     1.77134
   20    18 S   CT1  _CA2    20     1.46170   123.50523   179.37286
   21    20 S   HC   _HA2    21     1.09730   109.43981    -4.82044
   22    20 S   C    _C2_    22     1.53436   108.43467  -120.40158
   23    22 S   O    _O2_    23     1.23040   122.32866  -148.31896
   24    20 S   CT   _CB2    32     1.53424   111.37007   117.30946
   25    24 S   HC   HB21    33     1.09275   109.37111    56.36215
   26    24 S   HC   HB22    34     1.09413   110.00687   174.86634
   27    22 S   N    _N3_    24     1.38344   113.56103    39.12485
   28    27 S   H    _HN3    25     1.01628   119.49726    -3.49430
   29    24 S   S    _SG2    35     1.82886   111.06352   -65.43717
   30    27 S   CT   _CA3    26     1.45282   123.17036   177.07250
   31    30 S   HC   HA31    27     1.09550   107.51787   -64.29986
   32    30 S   HC   HA32    28     1.09558   107.96373    52.11985
   33    29 S   CT   _C14    36     1.87069   101.89280   166.95589
   34    30 S   CO3  _C3_    29     1.52943   114.11421   174.11863
   35    34 S   O2Z  _O31    30     1.26371   116.06084    -0.42933
   36    34 S   O2Z  _O32    31     1.26428   114.41165   179.63363
   37    33 S   CO4  _C13    37     1.54331   107.23304   176.77196
   38    37 S   O    _O34    38     1.22846   123.95224    21.08603
   39    33 S   CT   _C5_    51     1.55357   111.19912    57.94335
   40    39 S   HC   _H3_    52     1.09857   108.57098   -71.42635
   41    33 S   CT   _C15    57     1.56583   110.46256   -65.44720
   42    41 S   HC   _H13    58     1.09794   109.49485  -171.27573
   43    41 S   HC   _H14    59     1.09287   109.23693    74.71230
   44    37 S   CA   _C12    39     1.48544   117.51655  -162.30176
   45    39 S   CT   _C4_    53     1.53583   116.04736    50.17134
   46    45 S   HC   _H6_    54     1.09505   111.96962    52.51648
   47    45 S   HC   _H7_    55     1.09351   111.91014   -69.05835
   48    45 S   HC   _H8_    56     1.09639   110.66412   171.86588
   49    41 S   CM   _C16    60     1.51043   115.81157   -52.17114
   50    49 S   HC   _H15    61     1.08992   114.33995   -53.61934
   51    44 S   CA   _C11    40     1.40055   119.30843  -165.49563
   52    51 S   HA   _H12    41     1.08720   121.17097    -1.13935
   53    49 S   CM   _C17    62     1.34818   128.49675   128.17015
   54    51 S   CA   _C10    42     1.39544   120.10285   178.20136
   55    54 S   HA   _H11    43     1.08651   119.93366  -179.78694
   56    53 S   CT   _C18    63     1.50345   125.54460    -0.43476
   57    56 S   HC   _H16    64     1.09454   110.31960   117.81899
   58    56 S   HC   _H17    65     1.09097   113.80305    -2.59141
   59    56 S   HC   _H18    66     1.09483   110.09892  -122.87262
   60    53 S   CT   _C19    67     1.51811   119.57540   179.97202
   61    60 S   HC   _H19    68     1.09642   109.60318    23.93161
   62    60 S   HC   _H20    69     1.09660   109.39101   139.42648
   63    54 S   CA   _C9_    44     1.39338   120.10566    -0.04423
   64    63 S   HA   _H10    45     1.08646   119.97275  -179.90309
   65    60 S   CT   _C20    70     1.53152   111.89819   -98.42712
   66    65 S   HC   _H21    71     1.09645   110.22132    57.62693
   67    65 S   HC   _H22    72     1.09743   109.39523   -58.33742
   68    63 S   CA   _C8_    46     1.39476   120.06112     0.31959
   69    68 S   HA   _H9_    47     1.08708   118.89343   179.40521
   70    65 S   CT   _C21    73     1.53418   113.51969  -178.48173
   71    70 S   HC   _H23    74     1.09640   107.62910    62.81984
   72    70 S   HC   _H24    75     1.09776   107.81848   177.15119
   73    44 S   CA   _C7_    48     1.39671   121.01446    13.22277
   74    70 S   CT   _C22    76     1.54368   116.32214   -60.13621
   75    74 S   HC   _H4_    77     1.09710   108.82955    67.13107
   76    73 S   CO4  _C6_    49     1.47901   120.57194     3.12706
   77    76 S   O    _O33    50     1.22735   120.52221  -170.57523
   78    74 S   CT   _C23    78     1.53326   112.01149   -52.01818
   79    78 S   HC   _H25    79     1.09523   111.16968   -56.27455
   80    78 S   HC   _H26    80     1.09549   110.84645  -176.36719
   81    78 S   HC   _H27    81     1.09406   111.54641    64.66867
   82    74 S   CT   _C24    82     1.54561   111.56958  -174.11560
   83    82 S   HC   _H28    83     1.09790   108.69896   176.81125
   84    82 S   HC   _H29    84     1.09764   109.60974    60.72502
   85    82 S   CT   _C25    85     1.53222   113.97627   -62.16933
   86    85 S   HC   _H30    86     1.09448   108.96986   -53.28483
   87    85 S   HC   _H31    87     1.09510   110.21808    64.64592
   88    85 S   CT   _C26    88     1.53241   110.97557  -174.64665
   89    88 S   HC   _H32    89     1.09680   109.61875    61.21525
   90    88 S   HC   _H33    90     1.09810   108.54219   -54.27051
   91    88 S   CT   _C27    91     1.54114   113.58522  -174.97558
   92    91 S   HC   _H5_    92     1.09872   107.54287    60.56045
   93    91 S   CT   _C28    93     1.53268   109.64652   176.23558
   94    93 S   HC   _H34    94     1.09451   111.81171    59.33952
   95    93 S   HC   _H35    95     1.09502   110.93698  -179.72446
   96    93 S   HC   _H36    96     1.09549   110.52395   -60.49584
   97    91 S   CT   _C29    97     1.54280   114.65980   -57.82774
   98    97 S   HC   _H37    98     1.09798   108.46942  -179.16890
   99    97 S   HC   _H38    99     1.09705   109.13542    66.22927
  100    97 S   CT   _C30   100     1.53326   115.18184   -56.72475
  101   100 S   HC   _H39   101     1.09394   109.44080    61.24449
  102   100 S   HC   _H40   102     1.09512   110.21098   -56.85967
  103   100 S   CT   _C31   103     1.53271   110.88119  -177.74571
  104   103 S   HC   _H41   104     1.09612   109.27161   -60.28699
  105   103 S   HC   _H42   105     1.09767   108.58492    55.63006
  106   103 S   CT   _C32   106     1.53962   113.53061   176.78003
  107   106 S   HC   _H43   107     1.09734   108.71862   -55.02008
  108   106 S   CT   _C33   108     1.52938   112.47184    64.86163
  109   108 S   HC   _H44   109     1.09494   111.27029    56.59579
  110   108 S   HC   _H45   110     1.09546   110.71176   176.56322
  111   108 S   HC   _H46   111     1.09394   111.45419   -64.29140
  112   106 S   CT   _C34   112     1.53075   109.83778  -172.74174
  113   112 S   HC   _H47   113     1.09509   111.33267   -62.03676
  114   112 S   HC   _H48   114     1.09514   110.84277    58.27097
  115   112 S   HC   _H49   115     1.09521   110.81902   177.72566
  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  12   5   4   3
  19   2   1   1  15   5  14   8  10   4   3  10   6   3   2   1
  10   3   8   4  11   6   3   7   3   2   1   9   5   4   5   3
   9   5   4   4   2  12   5   4   2  12   8   1   1   7   3   2
   1   9   5   4   9   5   4  12   5   4  12   8   7   3   2   1
   9   5   4   9   5   4  12   5   4   9   8   7   3   2   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    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    39    41    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    44    76    39    40    45    41    42    43    49  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    44    51    73    76    77    39    40    45    46    47    48    41    42    43    49    50    53  
   35    36  
   36  
    0  
   38    44    51    52    54    68    73    76    39    40    45    41    42    43    49  
   44    51    73    39    41  
   40    45    46    47    48    41    42    43    49    44    68    73    76    77  
   45    46    47    48    41    73    76    77  
   42    43    49    50    53    56    60    44    45    76  
   43    49    50    53  
   49    50    53  
   51    52    54    55    63    68    69    73    76    77  
   46    47    48    73    76    77  
   47    48    76  
   48    76  
   76  
   50    53    56    57    58    59    60    61    62    65  
   53    56    60  
   52    54    55    63    64    68    73    76  
   54    55    63    73  
   56    57    58    59    60    61    62    65    66    67    70  
   55    63    64    68    69    73  
   63    64    68  
   57    58    59    60    61    62    65  
   58    59    60  
   59    60  
   60  
   61    62    65    66    67    70    71    72    74  
   62    65    66    67    70  
   65    66    67    70  
   64    68    69    73    76  
   68    69    73  
   66    67    70    71    72    74    75    78    82  
   67    70    71    72    74  
   70    71    72    74  
   69    73    76    77  
   73    76  
   71    72    74    75    78    79    80    81    82    83    84    85  
   72    74    75    78    82  
   74    75    78    82  
   76    77  
   75    78    79    80    81    82    83    84    85    86    87    88  
   78    79    80    81    82    83    84    85  
   77  
    0  
   79    80    81    82    83    84    85  
   80    81    82  
   81    82  
   82  
   83    84    85    86    87    88    89    90    91  
   84    85    86    87    88  
   85    86    87    88  
   86    87    88    89    90    91    92    93    97  
   87    88    89    90    91  
   88    89    90    91  
   89    90    91    92    93    94    95    96    97    98    99   100  
   90    91    92    93    97  
   91    92    93    97  
   92    93    94    95    96    97    98    99   100   101   102   103  
   93    94    95    96    97    98    99   100  
   94    95    96    97    98    99   100  
   95    96    97  
   96    97  
   97  
   98    99   100   101   102   103   104   105   106  
   99   100   101   102   103  
  100   101   102   103  
  101   102   103   104   105   106   107   108   112  
  102   103   104   105   106  
  103   104   105   106  
  104   105   106   107   108   109   110   111   112   113   114   115  
  105   106   107   108   112  
  106   107   108   112  
  107   108   109   110   111   112   113   114   115  
  108   109   110   111   112   113   114   115  
  109   110   111   112   113   114   115  
  110   111   112  
  111   112  
  112  
  113   114   115  
  114   115  
  115  
    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   0.167500   1.9750   1.7500   0.005000000  -0.741685710
   34   3.7500   0.1050   0.700000   2.1120   1.8750   0.001000000  -0.126889456
   35   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   36   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   37   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   38   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   39   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   40   2.4200   0.0150   0.060000   1.3810   1.2100   0.008598240   0.268726247
   41   3.5000   0.0660  -0.120000   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   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   45   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   46   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   47   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   48   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   3.5500   0.0760  -0.115000   2.0020   1.7750   0.023028004  -0.852763146
   50   2.4200   0.0300   0.115000   1.4250   1.2500   0.008598240   0.268726247
   51   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   52   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   53   3.5500   0.0760   0.000000   2.0020   1.7750   0.023028004  -0.852763146
   54   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   55   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   56   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   57   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   58   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   59   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   60   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   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   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   66   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   67   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   68   3.5500   0.0700  -0.115000   2.0020   1.7750   0.001000000  -0.843144165
   69   2.4200   0.0300   0.115000   1.3810   1.2100   0.030040813   0.268726247
   70   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   71   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   72   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   73   3.5500   0.0700  -0.115000   2.5000   1.7750   0.001000000  -0.843144165
   74   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   75   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   76   3.7500   0.1050   0.585000   2.1120   1.8750   0.001000000  -0.126889456
   77   2.9600   0.2100  -0.470000   1.6780   1.4800   0.001000000  -0.126889456
   78   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   79   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   80   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   81   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   82   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   83   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   84   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   85   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   86   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   87   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   88   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   89   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   90   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   91   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
   92   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   93   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   94   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   95   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   96   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   97   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
   98   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   99   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  100   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  101   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  102   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  103   3.5000   0.0660  -0.120000   1.9750   1.7500   0.005000000  -0.741685710
  104   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  105   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  106   3.5000   0.0660  -0.060000   1.9750   1.7500   0.005000000  -0.741685710
  107   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  108   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  109   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  110   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  111   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  112   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
  113   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  114   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
  115   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    34   317.000  1.522
   34    35   656.000  1.250
   34    36   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    37   317.000  1.522
   33    39   268.000  1.529
   33    41   268.000  1.529
   37    38   570.000  1.229
   37    44   310.000  1.470
   44    51   469.000  1.400
   44    73   469.000  1.400
   51    52   367.000  1.080
   51    54   469.000  1.400
   54    55   367.000  1.080
   54    63   469.000  1.400
   63    64   367.000  1.080
   63    68   469.000  1.400
   68    69   367.000  1.080
   68    73   469.000  1.400
   73    76   310.000  1.470
   76    77   570.000  1.229
   76    39   317.000  1.522
   39    40   340.000  1.090
   39    45   268.000  1.529
   45    46   340.000  1.090
   45    47   340.000  1.090
   45    48   340.000  1.090
   41    42   340.000  1.090
   41    43   340.000  1.090
   41    49   317.000  1.510
   49    50   340.000  1.080
   49    53   549.000  1.340
   53    56   317.000  1.510
   53    60   317.000  1.510
   56    57   340.000  1.090
   56    58   340.000  1.090
   56    59   340.000  1.090
   60    61   340.000  1.090
   60    62   340.000  1.090
   60    65   268.000  1.529
   65    66   340.000  1.090
   65    67   340.000  1.090
   65    70   268.000  1.529
   70    71   340.000  1.090
   70    72   340.000  1.090
   70    74   268.000  1.529
   74    75   340.000  1.090
   74    78   268.000  1.529
   74    82   268.000  1.529
   78    79   340.000  1.090
   78    80   340.000  1.090
   78    81   340.000  1.090
   82    83   340.000  1.090
   82    84   340.000  1.090
   82    85   268.000  1.529
   85    86   340.000  1.090
   85    87   340.000  1.090
   85    88   268.000  1.529
   88    89   340.000  1.090
   88    90   340.000  1.090
   88    91   268.000  1.529
   91    92   340.000  1.090
   91    93   268.000  1.529
   91    97   268.000  1.529
   93    94   340.000  1.090
   93    95   340.000  1.090
   93    96   340.000  1.090
   97    98   340.000  1.090
   97    99   340.000  1.090
   97   100   268.000  1.529
  100   101   340.000  1.090
  100   102   340.000  1.090
  100   103   268.000  1.529
  103   104   340.000  1.090
  103   105   340.000  1.090
  103   106   268.000  1.529
  106   107   340.000  1.090
  106   108   268.000  1.529
  106   112   268.000  1.529
  108   109   340.000  1.090
  108   110   340.000  1.090
  108   111   340.000  1.090
  112   113   340.000  1.090
  112   114   340.000  1.090
  112   115   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    34    63.00000  110.10000
   30    27    28    38.00000  118.40000
   30    34    35    70.00000  117.00000
   30    34    36    70.00000  117.00000
   32    30    31    33.00000  107.80000
   34    30    31    35.00000  109.50000
   34    30    32    35.00000  109.50000
   36    34    35    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    37    75.00000  110.18000
   29    33    39    75.00000  111.63000
   29    33    41    75.00000  111.63000
   33    37    38    80.00000  120.40000
   33    37    44    65.00000  115.47100
   33    39    76    63.00000  111.10000
   33    39    40    37.50000  110.70000
   33    39    45    58.35000  112.70000
   33    41    42    37.50000  110.70000
   33    41    43    37.50000  110.70000
   33    41    49    70.00000  112.02700
   37    44    51    60.00000  119.52600
   37    44    73    60.00000  119.52600
   44    37    38    75.00000  123.78400
   44    51    52    35.00000  120.00000
   44    51    54    63.00000  120.00000
   44    73    68    63.00000  120.00000
   44    73    76    60.00000  119.52600
   51    54    55    35.00000  120.00000
   51    54    63    63.00000  120.00000
   54    51    52    35.00000  120.00000
   54    63    64    35.00000  120.00000
   54    63    68    63.00000  120.00000
   63    54    55    35.00000  120.00000
   63    68    69    35.00000  120.00000
   63    68    73    63.00000  120.00000
   68    63    64    35.00000  120.00000
   68    73    76    60.00000  119.52600
   73    44    51    63.00000  120.00000
   73    68    69    35.00000  120.00000
   73    76    77    75.00000  123.78400
   73    76    39    65.00000  115.47100
   76    39    40    35.00000  109.50000
   76    39    45    63.00000  111.10000
   39    33    37    63.00000  111.10000
   39    76    77    80.00000  120.40000
   39    45    46    37.50000  110.70000
   39    45    47    37.50000  110.70000
   39    45    48    37.50000  110.70000
   45    39    40    37.50000  110.70000
   47    45    46    33.00000  107.80000
   48    45    46    33.00000  107.80000
   48    45    47    33.00000  107.80000
   41    33    37    63.00000  111.10000
   41    33    39    58.35000  112.70000
   41    49    50    35.00000  117.00000
   41    49    53    70.00000  124.00000
   43    41    42    33.00000  107.80000
   49    41    42    35.00000  109.50000
   49    41    43    35.00000  109.50000
   49    53    56    70.00000  124.00000
   49    53    60    70.00000  124.00000
   53    49    50    35.00000  120.00000
   53    56    57    35.00000  109.50000
   53    56    58    35.00000  109.50000
   53    56    59    35.00000  109.50000
   53    60    61    35.00000  109.50000
   53    60    62    35.00000  109.50000
   53    60    65    70.00000  112.02700
   58    56    57    33.00000  107.80000
   59    56    57    33.00000  107.80000
   59    56    58    33.00000  107.80000
   60    53    56    65.00000  117.92700
   60    65    66    37.50000  110.70000
   60    65    67    37.50000  110.70000
   60    65    70    58.35000  112.70000
   62    60    61    33.00000  107.80000
   65    60    61    37.50000  110.70000
   65    60    62    37.50000  110.70000
   65    70    71    37.50000  110.70000
   65    70    72    37.50000  110.70000
   65    70    74    58.35000  112.70000
   67    65    66    33.00000  107.80000
   70    65    66    37.50000  110.70000
   70    65    67    37.50000  110.70000
   70    74    75    37.50000  110.70000
   70    74    78    58.35000  112.70000
   70    74    82    58.35000  112.70000
   72    70    71    33.00000  107.80000
   74    70    71    37.50000  110.70000
   74    70    72    37.50000  110.70000
   74    78    79    37.50000  110.70000
   74    78    80    37.50000  110.70000
   74    78    81    37.50000  110.70000
   74    82    83    37.50000  110.70000
   74    82    84    37.50000  110.70000
   74    82    85    58.35000  112.70000
   78    74    75    37.50000  110.70000
   80    78    79    33.00000  107.80000
   81    78    79    33.00000  107.80000
   81    78    80    33.00000  107.80000
   82    74    75    37.50000  110.70000
   82    74    78    58.35000  112.70000
   82    85    86    37.50000  110.70000
   82    85    87    37.50000  110.70000
   82    85    88    58.35000  112.70000
   84    82    83    33.00000  107.80000
   85    82    83    37.50000  110.70000
   85    82    84    37.50000  110.70000
   85    88    89    37.50000  110.70000
   85    88    90    37.50000  110.70000
   85    88    91    58.35000  112.70000
   87    85    86    33.00000  107.80000
   88    85    86    37.50000  110.70000
   88    85    87    37.50000  110.70000
   88    91    92    37.50000  110.70000
   88    91    93    58.35000  112.70000
   88    91    97    58.35000  112.70000
   90    88    89    33.00000  107.80000
   91    88    89    37.50000  110.70000
   91    88    90    37.50000  110.70000
   91    93    94    37.50000  110.70000
   91    93    95    37.50000  110.70000
   91    93    96    37.50000  110.70000
   91    97    98    37.50000  110.70000
   91    97    99    37.50000  110.70000
   91    97   100    58.35000  112.70000
   93    91    92    37.50000  110.70000
   95    93    94    33.00000  107.80000
   96    93    94    33.00000  107.80000
   96    93    95    33.00000  107.80000
   97    91    92    37.50000  110.70000
   97    91    93    58.35000  112.70000
   97   100   101    37.50000  110.70000
   97   100   102    37.50000  110.70000
   97   100   103    58.35000  112.70000
   99    97    98    33.00000  107.80000
  100    97    98    37.50000  110.70000
  100    97    99    37.50000  110.70000
  100   103   104    37.50000  110.70000
  100   103   105    37.50000  110.70000
  100   103   106    58.35000  112.70000
  102   100   101    33.00000  107.80000
  103   100   101    37.50000  110.70000
  103   100   102    37.50000  110.70000
  103   106   107    37.50000  110.70000
  103   106   108    58.35000  112.70000
  103   106   112    58.35000  112.70000
  105   103   104    33.00000  107.80000
  106   103   104    37.50000  110.70000
  106   103   105    37.50000  110.70000
  106   108   109    37.50000  110.70000
  106   108   110    37.50000  110.70000
  106   108   111    37.50000  110.70000
  106   112   113    37.50000  110.70000
  106   112   114    37.50000  110.70000
  106   112   115    37.50000  110.70000
  108   106   107    37.50000  110.70000
  110   108   109    33.00000  107.80000
  111   108   109    33.00000  107.80000
  111   108   110    33.00000  107.80000
  112   106   107    37.50000  110.70000
  112   106   108    58.35000  112.70000
  114   112   113    33.00000  107.80000
  115   112   113    33.00000  107.80000
  115   112   114    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
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  103   106   112   115   0.15000  1.0 3.0
  104   103   106   107   0.15000  1.0 3.0
  104   103   106   108   0.15000  1.0 3.0
  104   103   106   112   0.15000  1.0 3.0
  105   103   106   107   0.15000  1.0 3.0
  105   103   106   108   0.15000  1.0 3.0
  105   103   106   112   0.15000  1.0 3.0
  107   106   108   109   0.15000  1.0 3.0
  107   106   108   110   0.15000  1.0 3.0
  107   106   108   111   0.15000  1.0 3.0
  107   106   112   113   0.15000  1.0 3.0
  107   106   112   114   0.15000  1.0 3.0
  107   106   112   115   0.15000  1.0 3.0
  108   106   112   113   0.15000  1.0 3.0
  108   106   112   114   0.15000  1.0 3.0
  108   106   112   115   0.15000  1.0 3.0
  112   106   108   109   0.15000  1.0 3.0
  112   106   108   110   0.15000  1.0 3.0
  112   106   108   111   0.15000  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
   35    30    34    36  10.50000 -1.0 2.0
   33    44    37    38  10.50000 -1.0 2.0
   51    73    44    37   4.00000 -1.0 2.0
   54    52    51    44   1.10000 -1.0 2.0
   63    55    54    51   1.10000 -1.0 2.0
   68    64    63    54   1.10000 -1.0 2.0
   73    69    68    63   1.10000 -1.0 2.0
   68    76    73    44   4.00000 -1.0 2.0
   73    39    76    77  10.50000 -1.0 2.0
   41    50    49    53  15.00000 -1.0 2.0
   56    60    53    49  15.00000 -1.0 2.0
END
