* LIGAND DATABASE FILE (OPLS2005)
*
001      52    52     92    135     264
    1     0 S   NP   _N1_     1    29.07676    94.61200   -22.12590
    2     1 S   H    _HN1     2     1.02945    82.63183   -10.36473
    3     1 S   H    _H1_     3     1.02822    30.80967   132.48504
    4     1 S   H    _H2_     4     1.02785    99.19416  -117.86297
    5     1 S   CT   _CA1     5     1.50123   138.76925   102.33023
    6     5 S   HC   _HA1     6     1.09571   105.19356    75.35846
    7     5 S   CO3  _C1_     7     1.53810   112.29289   -44.88092
    8     7 S   O2Z  _O11     8     1.26383   114.98992   -45.35187
    9     7 S   O2Z  _O12     9     1.26219   114.97569   133.50213
   10     5 S   CT   _CB1    10     1.53059   107.37469  -166.66993
   11    10 S   HC   HB11    11     1.09837   109.53627   -49.09925
   12    10 S   HC   HB12    12     1.09807   110.42389    67.56489
   13    10 S   CT   _CG1    13     1.52948   112.48236  -169.97254
   14    13 S   HC   HG11    14     1.09522   110.55232   -65.53832
   15    13 S   HC   HG12    15     1.09649   109.76702    53.68558
   16    13 S   C    _CD1    16     1.51744   111.99779   174.73233
   17    16 S   O    _OE1    17     1.22771   123.10168    16.20572
   18    16 S   N    _N2_    18     1.38475   111.89167  -164.69167
   19    18 S   H    _HN2    19     1.01930   119.12998     2.93118
   20    18 S   CT1  _CA2    20     1.46019   123.68223   179.64502
   21    20 S   HC   _HA2    21     1.09738   109.16614     5.72759
   22    20 S   C    _C2_    22     1.53575   109.28500  -109.89839
   23    22 S   O    _O2_    23     1.23107   122.10452  -151.30723
   24    20 S   CT   _CB2    32     1.53329   111.45423   127.43024
   25    24 S   HC   HB21    33     1.09342   110.52594    60.24083
   26    24 S   HC   HB22    34     1.09550   110.18357   177.91550
   27    22 S   N    _N3_    24     1.38310   113.94175    36.54283
   28    27 S   H    _HN3    25     1.01561   119.53199    -5.01903
   29    24 S   S    _SG2    35     1.82733   111.64541   -63.65841
   30    27 S   CT   _CA3    26     1.45271   123.18572   176.80408
   31    30 S   HC   HA31    27     1.09556   107.65027   -60.08918
   32    30 S   HC   HA32    28     1.09555   107.80249    56.29379
   33    29 S   CT   _C7_    36     1.84373   100.57765   128.50081
   34    33 S   HC   _H3_    37     1.09234   110.31369    31.13508
   35    30 S   CO3  _C3_    29     1.52958   114.16431   178.09340
   36    35 S   O2Z  _O31    30     1.26379   116.11289    -2.84124
   37    35 S   O2Z  _O32    31     1.26453   114.40317   177.18207
   38    33 S   CM   _C6_    38     1.50076   108.75416   -96.56931
   39    38 S   OS   _O34    39     1.40313   110.96189   -85.12112
   40    38 S   CM   _C5_    45     1.34456   128.55628   100.70558
   41    39 S   CO4  _C9_    40     1.37396   105.71468   -18.91492
   42    41 S   O    _O33    41     1.22230   123.63084   177.81099
   43    40 S   CO3  _C10    46     1.53475   119.92729    -1.08119
   44    43 S   O2Z  _O36    47     1.26339   115.31110    67.97012
   45    43 S   O2Z  _O35    48     1.26439   114.75332  -112.67339
   46    40 S   CT   _C4_    49     1.50032   124.61339   177.97059
   47    46 S   HC   _H5_    50     1.09462   110.38968   123.62673
   48    46 S   HC   _H6_    51     1.09408   112.75946     3.43895
   49    46 S   HC   _H7_    52     1.09484   110.04593  -116.96766
   50    33 S   CT   _C8_    42     1.51871   114.52074   155.76126
   51    50 S   Cl   Cl1_    43     1.76496   116.46839   -41.86077
   52    50 S   HC   _H4_    44     1.09731   110.85710  -165.12402
  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
  11   7   2   1   1  14   8   9   4   3   6   2   1   3   2   1
   1   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    35    24    25    26    29  
   27    28    30    24  
   25    26    29    33    34    38    50    27  
   26    29    33  
   29    33  
   28    30    31    32    35    36    37  
   30    31    32    35  
   33    34    38    39    41    50    51    52    40  
   31    32    35    36    37  
   32    35    36    37  
   35    36    37  
   34    38    39    41    42    50    51    52    40    43    46  
   38    39    41    50    51    52    40  
   36    37  
   37  
    0  
   39    41    42    50    51    52    40    43    44    45    46    47    48    49  
   41    42    50    51    52    40    43    46  
   43    44    45    46    47    48    49    41    50  
   42    50    51    52  
   50    51    52  
   44    45    46    47    48    49  
   45    46  
   46  
   47    48    49  
   48    49  
   49  
    0  
   51    52  
   52  
    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   0.107500   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   0.0760   0.085000   2.0020   1.7750   0.023028004  -0.852763146
   39   2.8500   0.1400  -0.165000   1.5900   1.4000   0.020110767  -0.896042159
   40   3.5500   0.0760  -0.310300   2.0020   1.7750   0.023028004  -0.852763146
   41   3.7500   0.1050   0.510000   2.1120   1.8750   0.001000000  -0.126889456
   42   2.9600   0.2100  -0.430000   1.6780   1.4800   0.001000000  -0.126889456
   43   3.7500   0.1050   0.910300   2.1120   1.8750   0.001000000  -0.126889456
   44   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   45   2.9600   0.2100  -0.800000   1.7000   1.5000   0.001000000  -0.126889456
   46   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   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   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660   0.097000   1.9750   1.7500   0.005000000  -0.741685710
   51   3.4000   0.3000  -0.200000   2.1950   1.9500   0.001000000   0.320982824
   52   2.4200   0.0150   0.103000   1.3810   1.2100   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   317.000  1.510
   33    50   268.000  1.529
   38    39   440.000  1.360
   38    40   549.000  1.340
   39    41   214.000  1.327
   41    42   570.000  1.229
   41    50   317.000  1.522
   50    51   245.000  1.781
   50    52   340.000  1.090
   40    43   230.000  1.545
   40    46   317.000  1.510
   43    44   656.000  1.250
   43    45   656.000  1.250
   46    47   340.000  1.090
   46    48   340.000  1.090
   46    49   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    35.00000  109.50000
   29    33    38    75.00000  112.20000
   29    33    50    75.00000  111.63000
   33    38    39    85.00000  112.85300
   33    38    40    70.00000  124.00000
   33    50    41    63.00000  111.10000
   33    50    51    69.00000  109.80000
   33    50    52    37.50000  110.70000
   38    33    34    35.00000  109.50000
   38    39    41    90.00000  114.22900
   38    40    43    55.00000  124.75400
   38    40    46    70.00000  124.00000
   39    41    42    83.00000  123.40000
   39    41    50    81.00000  111.40000
   41    50    51    70.00000  110.66000
   41    50    52    35.00000  109.50000
   50    33    34    37.50000  110.70000
   50    33    38    70.00000  112.02700
   50    41    42    80.00000  120.40000
   52    50    51    51.00000  107.60000
   40    38    39    80.00000  120.01400
   40    43    44    85.00000  113.83300
   40    43    45    85.00000  113.83300
   40    46    47    35.00000  109.50000
   40    46    48    35.00000  109.50000
   40    46    49    35.00000  109.50000
   45    43    44    80.00000  126.00000
   46    40    43    65.00000  117.04000
   48    46    47    33.00000  107.80000
   49    46    47    33.00000  107.80000
   49    46    48    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   0.32350  1.0 3.0
   24    29    33    38  -0.62250  1.0 1.0
   24    29    33    38  -0.38450 -1.0 2.0
   24    29    33    38   0.81900  1.0 3.0
   24    29    33    50   0.01700  1.0 1.0
   24    29    33    50  -0.23550 -1.0 2.0
   24    29    33    50   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   0.09700  1.0 1.0
   29    33    38    39   0.15600 -1.0 2.0
   29    33    38    39  -0.50800  1.0 3.0
   29    33    38    40   0.42700  1.0 1.0
   29    33    38    40  -0.70350 -1.0 2.0
   29    33    38    40  -0.43150  1.0 3.0
   29    33    50    41   0.56750  1.0 1.0
   29    33    50    41  -0.07550 -1.0 2.0
   29    33    50    41   0.20000  1.0 3.0
   29    33    50    51   0.56750  1.0 1.0
   29    33    50    51  -0.07550 -1.0 2.0
   29    33    50    51   0.20000  1.0 3.0
   29    33    50    52   0.15000  1.0 3.0
   33    38   -39    41   2.00000 -1.0 2.0
   33    38    40    43   7.00000 -1.0 2.0
   33    38    40    46   7.00000 -1.0 2.0
   34    33    38    39   0.00000  1.0 1.0
   34    33    38    40   0.00000  1.0 1.0
   34    33    50    41  -0.11250  1.0 3.0
   34    33    50    51   0.27000  1.0 3.0
   34    33    50    52   0.15000  1.0 3.0
   38    33   -50    41  -0.98800  1.0 1.0
   38    33   -50    41   0.48800 -1.0 2.0
   38    33   -50    41   0.76800  1.0 3.0
   38    33    50    51   0.56750  1.0 1.0
   38    33    50    51  -0.07550 -1.0 2.0
   38    33    50    51   0.20000  1.0 3.0
   38    33    50    52   0.15000  1.0 3.0
   38    39    41    42   3.00000 -1.0 2.0
   38    39   -41    50   0.82650  1.0 1.0
   38    39   -41    50   1.69000 -1.0 2.0
   38    40    43    44  -0.04000 -1.0 2.0
   38    40    43    44  -0.29050  1.0 3.0
   38    40    43    45  -0.04000 -1.0 2.0
   38    40    43    45  -0.29050  1.0 3.0
   38    40    46    47   0.00000  1.0 1.0
   38    40    46    48   0.00000  1.0 1.0
   38    40    46    49   0.00000  1.0 1.0
   39    38    40    43   7.00000 -1.0 2.0
   39    38    40    46   7.00000 -1.0 2.0
   39    41   -50    33   0.36750  1.0 3.0
   39    41    50    51   0.40000  1.0 3.0
   39    41    50    52   0.00000  1.0 1.0
   42    41    50    33   0.30150 -1.0 2.0
   42    41    50    51   0.30150 -1.0 2.0
   42    41    50    52   0.00000  1.0 1.0
   50    33   -38    39   0.09700  1.0 1.0
   50    33   -38    39   0.15600 -1.0 2.0
   50    33   -38    39  -0.50800  1.0 3.0
   50    33    38    40   0.09850  1.0 1.0
   50    33    38    40   0.15250 -1.0 2.0
   50    33    38    40  -0.50650  1.0 3.0
   40    38    39    41  -1.93650  1.0 1.0
   40    38    39    41   2.17750 -1.0 2.0
   40    38    39    41  -0.40250  1.0 3.0
   43    40    46    47   0.15000  1.0 3.0
   43    40    46    48   0.15000  1.0 3.0
   43    40    46    49   0.15000  1.0 3.0
   46    40    43    44  -0.64400  1.0 1.0
   46    40    43    44   0.26850 -1.0 2.0
   46    40    43    45  -0.64400  1.0 1.0
   46    40    43    45   0.26850 -1.0 2.0
IPHI
    8     5     7     9  10.50000 -1.0 2.0
   13    18    16    17  10.50000 -1.0 2.0
   19    16    18    20   1.00000 -1.0 2.0
   20    27    22    23  10.50000 -1.0 2.0
   28    22    27    30   1.00000 -1.0 2.0
   36    30    35    37  10.50000 -1.0 2.0
   33    39    38    40   1.10000 -1.0 2.0
   39    50    41    42  10.50000 -1.0 2.0
   43    46    40    38   1.10000 -1.0 2.0
   44    40    43    45  10.50000 -1.0 2.0
END
