* LIGAND DATABASE FILE (OPLS2005)
*
001      53    53     91    131     261
    1     0 S   NP   _N1_     1    28.93428    93.90676   -25.06310
    2     1 S   H    _HN1     2     1.02950    88.25647     3.69316
    3     1 S   H    _H1_     3     1.02829    18.82140  -177.61821
    4     1 S   H    _H2_     4     1.02788   114.88684  -105.78072
    5     1 S   CT   _CA1     5     1.50109   119.60834   116.28089
    6     5 S   HC   _HA1     6     1.09574   105.19396    77.62195
    7     5 S   CO3  _C1_     7     1.53786   112.47743   -42.62314
    8     7 S   O2Z  _O11     8     1.26373   115.00595   -42.41435
    9     7 S   O2Z  _O12     9     1.26240   114.94766   136.73131
   10     5 S   CT   _CB1    10     1.53081   107.42522  -164.38390
   11    10 S   HC   HB11    11     1.09835   109.37521   -49.64088
   12    10 S   HC   HB12    12     1.09813   110.44980    66.97005
   13    10 S   CT   _CG1    13     1.52995   112.60295  -170.60715
   14    13 S   HC   HG11    14     1.09579   110.65567   -65.87717
   15    13 S   HC   HG12    15     1.09671   109.76159    53.35383
   16    13 S   C    _CD1    16     1.51800   112.19696   173.82772
   17    16 S   O    _OE1    17     1.22732   123.28210     8.13600
   18    16 S   N    _N2_    18     1.38657   111.70061  -172.00370
   19    18 S   H    _HN2    19     1.01586   118.92435     1.71395
   20    18 S   CT1  _CA2    20     1.46200   123.38562   177.08328
   21    20 S   HC   _HA2    21     1.09735   109.36885     3.34088
   22    20 S   C    _C2_    22     1.53580   108.57052  -112.11842
   23    22 S   O    _O2_    23     1.23058   122.29971  -147.66788
   24    20 S   CT   _CB2    32     1.53291   111.62453   125.39843
   25    24 S   HC   HB21    33     1.09638   110.01716    56.21371
   26    24 S   HC   HB22    34     1.09565   110.02139   175.18830
   27    22 S   N    _N3_    24     1.38330   113.69785    39.76601
   28    27 S   H    _HN3    25     1.01578   119.59760    -3.24238
   29    24 S   S    _SG2    35     1.83104   111.47709   -64.86401
   30    27 S   CT   _CA3    26     1.45286   123.24511   177.18026
   31    30 S   HC   HA31    27     1.09549   107.51019   -64.75782
   32    30 S   HC   HA32    28     1.09556   107.99433    51.69422
   33    29 S   CQ   _C8_    36     1.78536   101.18128   179.52276
   34    30 S   CO3  _C3_    29     1.52970   114.04853   173.69289
   35    34 S   O2Z  _O31    30     1.26381   116.06053    -0.59873
   36    34 S   O2Z  _O32    31     1.26425   114.41675   179.46259
   37    33 S   NB   _N6_    37     1.34032   116.10311  -179.11331
   38    37 S   CQ   _C7_    38     1.34056   115.60981  -179.97202
   39    38 S   NB   _N5_    39     1.34423   123.56661     0.00000
   40    38 S   NE   _N8_    51     1.38150   118.23251  -180.00000
   41    40 S   H    _H9_    52     1.00955   119.59110  -180.00000
   42    40 S   H    _H10    53     1.00959   119.57853    -0.03426
   43    39 S   CQ   _C6_    40     1.34510   117.08873     0.02798
   44    33 S   NB   _N7_    41     1.34003   119.15535     0.94128
   45    43 S   NE   _N4_    42     1.38318   117.02803   179.96044
   46    45 S   H    _H8_    43     1.01200   117.43308    -0.06256
   47    45 S   CT   _C5_    44     1.44631   121.62439  -179.82754
   48    47 S   HC   _H6_    45     1.09614   110.24399   -59.69451
   49    47 S   HC   _H7_    46     1.09615   110.24655    59.65100
   50    47 S   CT   _C4_    47     1.51945   109.95368   180.00000
   51    50 S   HC   _H3_    48     1.09523   111.01200   -59.95882
   52    50 S   HC   _H4_    49     1.09522   111.01235    59.93536
   53    50 S   HC   _H5_    50     1.09435   110.41022   180.00000
  12   6   5   4  11   7   6   2   1   8   5   4   7   4   3   7
   3  10   4  11   7  11   4   7   3   2   7   4   5   5   4   3
   7   2   1   1   7   7   8   3   1   1   7   3   8   4   6   5
   4   3   2   1   1
    2     3     4     5     6     7     8     9    10    11    12    13  
    3     4     5     6     7    10  
    4     5     6     7    10  
    5     6     7    10  
    6     7     8     9    10    11    12    13    14    15    16  
    7     8     9    10    11    12    13  
    8     9    10    11    12    13  
    9    10  
   10  
   11    12    13    14    15    16    17    18  
   12    13    14    15    16  
   13    14    15    16  
   14    15    16    17    18    19    20  
   15    16    17    18  
   16    17    18  
   17    18    19    20    21    22    24  
   18    19    20  
   19    20    21    22    23    27    24    25    26    29  
   20    21    22    24  
   21    22    23    27    28    30    24    25    26    29    33  
   22    23    27    24    25    26    29  
   23    27    28    30    31    32    34    24    25    26    29  
   27    28    30    24  
   25    26    29    33    37    44    27  
   26    29    33  
   29    33  
   28    30    31    32    34    35    36  
   30    31    32    34  
   33    37    38    43    44  
   31    32    34    35    36  
   32    34    35    36  
   34    35    36  
   37    38    39    43    44    45    40  
   35    36  
   36  
    0  
   38    39    43    44    40    41    42  
   39    43    44    45    40    41    42  
   43    44    45    46    47    40    41    42  
   41    42    43  
   42  
    0  
   44    45    46    47    48    49    50  
   45    46    47  
   46    47    48    49    50    51    52    53  
   47    48    49    50  
   48    49    50    51    52    53  
   49    50    51    52    53  
   50    51    52    53  
   51    52    53  
   52    53  
   53  
    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  -0.320000   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   3.5500   0.0700   1.078700   2.5000   1.7750   0.001000000  -0.843144165
   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   3.2800   0.1700  -0.926200   1.8000   1.6000   0.001000000  -0.511443539
   38   3.5500   0.0700   1.126200   2.0020   1.7750   0.001000000  -0.843144165
   39   3.2800   0.1700  -0.926200   1.8000   1.6000   0.001000000  -0.511443539
   40   3.3000   0.1700  -0.920000   1.8650   1.6500   0.051222218  -2.220205820
   41   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   42   0.5000   0.0300   0.360000   0.9960   0.8600   0.030040813  -0.651083722
   43   3.5500   0.0700   1.126200   2.0020   1.7750   0.001000000  -0.843144165
   44   3.2800   0.1700  -0.926200   1.8000   1.6000   0.001000000  -0.511443539
   45   3.3000   0.1700  -0.780000   1.8650   1.6500   0.051222218  -2.220205820
   46   0.5000   0.0300   0.380000   0.9960   0.8600   0.030040813  -0.651083722
   47   3.5000   0.0660   0.080000   1.9750   1.7500   0.005000000  -0.741685710
   48   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   49   2.5000   0.0150   0.060000   1.4250   1.2500   0.008598240   0.268726247
   50   3.5000   0.0660  -0.180000   1.9750   1.7500   0.005000000  -0.741685710
   51   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   52   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
   53   2.5000   0.0300   0.060000   1.4250   1.2500   0.008598240   0.268726247
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   225.000  1.774
   33    37   502.000  1.324
   33    44   502.000  1.324
   37    38   502.000  1.324
   38    39   502.000  1.324
   38    40   410.000  1.375
   39    43   502.000  1.324
   43    44   502.000  1.324
   43    45   410.000  1.375
   45    46   434.000  1.010
   45    47   382.000  1.448
   47    48   340.000  1.090
   47    49   340.000  1.090
   47    50   268.000  1.529
   50    51   340.000  1.090
   50    52   340.000  1.090
   50    53   340.000  1.090
   40    41   434.000  1.010
   40    42   434.000  1.010
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    80.00000   99.04000
   26    24    25    33.00000  107.80000
   29    24    25    35.00000  109.50000
   29    24    26    35.00000  109.50000
   29    33    37    80.00000  114.04000
   29    33    44    80.00000  114.04000
   33    37    38    85.00000  113.71000
   33    44    43    85.00000  113.71000
   37    38    39    70.00000  129.10000
   37    38    40    85.00000  116.09700
   38    39    43    85.00000  113.71000
   38    40    41    50.00000  113.31100
   38    40    42    50.00000  113.31100
   39    43    44    70.00000  129.10000
   39    43    45    85.00000  116.09700
   43    45    46    50.00000  113.31100
   43    45    47    50.00000  123.00000
   44    33    37    70.00000  129.10000
   45    43    44    85.00000  116.09700
   45    47    48    35.00000  109.50000
   45    47    49    35.00000  109.50000
   45    47    50    80.00000  111.61500
   47    45    46    35.00000  112.50000
   47    50    51    37.50000  110.70000
   47    50    52    37.50000  110.70000
   47    50    53    37.50000  110.70000
   49    47    48    33.00000  107.80000
   50    47    48    37.50000  110.70000
   50    47    49    37.50000  110.70000
   52    50    51    33.00000  107.80000
   53    50    51    33.00000  107.80000
   53    50    52    33.00000  107.80000
   40    38    39    85.00000  116.09700
   42    40    41    35.00000  109.00000
PHI
    1     5     7     8   0.30150 -1.0 2.0
    1     5     7     9   0.30150 -1.0 2.0
    1     5    10    11   0.19200  1.0 3.0
    1     5    10    12   0.19200  1.0 3.0
    1     5    10    13   1.36600  1.0 1.0
    1     5    10    13  -0.11450 -1.0 2.0
    1     5    10    13   0.24250  1.0 3.0
    2     1     5     6   0.13050  1.0 3.0
    2     1     5     7   0.17350  1.0 3.0
    2     1     5    10   0.17350  1.0 3.0
    3     1     5     6   0.13050  1.0 3.0
    3     1     5     7   0.17350  1.0 3.0
    3     1     5    10   0.17350  1.0 3.0
    4     1     5     6   0.13050  1.0 3.0
    4     1     5     7   0.17350  1.0 3.0
    4     1     5    10   0.17350  1.0 3.0
    5    10    13    14   0.15000  1.0 3.0
    5    10    13    15   0.15000  1.0 3.0
    5    10    13    16  -0.95700  1.0 1.0
    5    10    13    16  -0.18200 -1.0 2.0
    5    10    13    16   0.29450  1.0 3.0
    6     5     7     8   0.00000  1.0 1.0
    6     5     7     9   0.00000  1.0 1.0
    6     5    10    11   0.15000  1.0 3.0
    6     5    10    12   0.15000  1.0 3.0
    6     5    10    13   0.15000  1.0 3.0
    7     5    10    11  -0.11250  1.0 3.0
    7     5    10    12  -0.11250  1.0 3.0
    7     5    10    13  -1.63150  1.0 1.0
    7     5    10    13  -0.43550 -1.0 2.0
    7     5    10    13   0.24500  1.0 3.0
   10     5     7     8   0.41150 -1.0 2.0
   10     5     7     9   0.41150 -1.0 2.0
   10    13    16    17   0.30150 -1.0 2.0
   10    13    16    18   1.39750  1.0 1.0
   10    13    16    18  -0.07950 -1.0 2.0
   10    13    16    18  -0.18750  1.0 3.0
   11    10    13    14   0.15000  1.0 3.0
   11    10    13    15   0.15000  1.0 3.0
   11    10    13    16  -0.11250  1.0 3.0
   12    10    13    14   0.15000  1.0 3.0
   12    10    13    15   0.15000  1.0 3.0
   12    10    13    16  -0.11250  1.0 3.0
   13    16    18    19   2.45000 -1.0 2.0
   13    16    18    20   1.15000  1.0 1.0
   13    16    18    20   3.04450 -1.0 2.0
   14    13    16    17   0.00000  1.0 1.0
   14    13    16    18   0.00000  1.0 1.0
   15    13    16    17   0.00000  1.0 1.0
   15    13    16    18   0.00000  1.0 1.0
   16    18    20    21   0.00000  1.0 1.0
   16    18    20    22  -0.29800  1.0 1.0
   16    18    20    22   0.13950 -1.0 2.0
   16    18    20    22  -2.45650  1.0 3.0
   16    18    20    24   0.25950  1.0 1.0
   16    18    20    24   0.43850 -1.0 2.0
   16    18    20    24   2.61650  1.0 3.0
   17    16    18    19   2.45000 -1.0 2.0
   17    16    18    20   3.04450 -1.0 2.0
   18    20    22    23   0.00000  1.0 1.0
   18    20    22    27   0.37150  1.0 1.0
   18    20    22    27   1.25400 -1.0 2.0
   18    20    22    27  -0.40250  1.0 3.0
   18    20    24    25   0.23200  1.0 3.0
   18    20    24    26   0.23200  1.0 3.0
   18    20    24    29   0.71400  1.0 1.0
   18    20    24    29   0.04300 -1.0 2.0
   18    20    24    29   0.01450  1.0 3.0
   19    18    20    21   0.00000  1.0 1.0
   19    18    20    22   0.00000  1.0 1.0
   19    18    20    24   0.00000  1.0 1.0
   20    22    27    28   2.45000 -1.0 2.0
   20    22    27    30   1.15000  1.0 1.0
   20    22    27    30   3.04450 -1.0 2.0
   20    24    29    33  -0.35400  1.0 1.0
   20    24    29    33  -0.24450 -1.0 2.0
   20    24    29    33   0.44000  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    34  -0.29800  1.0 1.0
   22    27    30    34   0.13950 -1.0 2.0
   22    27    30    34  -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    34    35   0.00000  1.0 1.0
   27    30    34    36   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    34   0.00000  1.0 1.0
   31    30    34    35   0.00000  1.0 1.0
   31    30    34    36   0.00000  1.0 1.0
   32    30    34    35   0.00000  1.0 1.0
   32    30    34    36   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    37   0.63150 -1.0 2.0
   24    29    33    44   0.63150 -1.0 2.0
   25    24    29    33   0.24000  1.0 3.0
   26    24    29    33   0.24000  1.0 3.0
   29    33    37    38   3.62500 -1.0 2.0
   29    33    44    43   3.62500 -1.0 2.0
   33    37    38    39   3.62500 -1.0 2.0
   33    37    38    40   3.62500 -1.0 2.0
   37    33    44    43   3.62500 -1.0 2.0
   37    38   -39    43   3.62500 -1.0 2.0
   37    38    40    41   1.75000 -1.0 2.0
   37    38    40    42   1.75000 -1.0 2.0
   38    39    43    44   3.62500 -1.0 2.0
   38    39    43    45   3.62500 -1.0 2.0
   39    38    40    41   1.75000 -1.0 2.0
   39    38    40    42   1.75000 -1.0 2.0
   39    43   -44    33   3.62500 -1.0 2.0
   39    43    45    46   1.75000 -1.0 2.0
   39    43    45    47  -1.10000  1.0 1.0
   39    43    45    47   1.25000 -1.0 2.0
   43    45    47    48   0.00000  1.0 1.0
   43    45    47    49   0.00000  1.0 1.0
   43    45    47    50   0.92500  1.0 1.0
   43    45    47    50   0.12150 -1.0 2.0
   43    45    47    50  -0.25000  1.0 3.0
   44    33   -37    38   3.62500 -1.0 2.0
   44    43    45    46   1.75000 -1.0 2.0
   44    43    45    47  -1.10000  1.0 1.0
   44    43    45    47   1.25000 -1.0 2.0
   45    43    44    33   3.62500 -1.0 2.0
   45    47    50    51   0.22950  1.0 3.0
   45    47    50    52   0.22950  1.0 3.0
   45    47    50    53   0.22950  1.0 3.0
   46    45    47    48   0.00000  1.0 1.0
   46    45    47    49   0.00000  1.0 1.0
   46    45    47    50   0.00000  1.0 1.0
   48    47    50    51   0.15000  1.0 3.0
   48    47    50    52   0.15000  1.0 3.0
   48    47    50    53   0.15000  1.0 3.0
   49    47    50    51   0.15000  1.0 3.0
   49    47    50    52   0.15000  1.0 3.0
   49    47    50    53   0.15000  1.0 3.0
   40    38    39    43   3.62500 -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
   35    30    34    36  10.50000 -1.0 2.0
   37    44    33    29   4.00000 -1.0 2.0
   39    40    38    37   4.00000 -1.0 2.0
   44    45    43    39   4.00000 -1.0 2.0
   46    43    45    47   1.00000 -1.0 2.0
   42    38    40    41   1.00000 -1.0 2.0
END
