REMARK  Name = BDB048488
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.830  -0.692   0.215  0.00  0.00    +0.139 A 
ATOM      2  C   LIG    1        1.462  -1.688   0.972  0.00  0.00    +0.094 A 
ATOM      3  C   LIG    1        2.864  -1.747   0.986  0.00  0.00    -0.027 A 
ATOM      4  C   LIG    1        3.612  -2.782   1.779  0.00  0.00    +0.045 C 
ATOM      5  C   LIG    1        3.575  -0.811   0.227  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1        2.895   0.142  -0.516  0.00  0.00    +0.126 A 
ATOM      7  N   LIG    1        1.543   0.193  -0.522  0.00  0.00    -0.216 NA
ENDROOT
BRANCH   1   8
ATOM      8  N   LIG    1       -0.575  -0.636   0.153  0.00  0.00    -0.325 N 
ATOM      9  H   LIG    1       -0.974  -0.663   1.092  0.00  0.00    +0.148 HD
BRANCH   8  10
ATOM     10  C   LIG    1       -1.130   0.496  -0.596  0.00  0.00    +0.144 C 
BRANCH  10  11
ATOM     11  C   LIG    1       -2.662   0.429  -0.562  0.00  0.00    +0.247 C 
BRANCH  11  12
ATOM     12  O   LIG    1       -3.091   0.575   0.804  0.00  0.00    -0.489 OA
BRANCH  12  18
ATOM     13  C   LIG    1       -8.470  -0.843   1.495  0.00  0.00    +0.065 C 
ATOM     14  C   LIG    1       -7.041  -0.440   1.290  0.00  0.00    +0.039 A 
ATOM     15  N   LIG    1       -6.087  -1.287   1.746  0.00  0.00    -0.253 NA
ATOM     16  C   LIG    1       -4.786  -0.936   1.577  0.00  0.00    +0.080 A 
ATOM     17  C   LIG    1       -3.755  -1.892   2.101  0.00  0.00    +0.069 C 
ATOM     18  C   LIG    1       -4.411   0.243   0.933  0.00  0.00    +0.141 A 
ATOM     19  C   LIG    1       -5.401   1.112   0.488  0.00  0.00    +0.049 A 
ATOM     20  C   LIG    1       -6.737   0.765   0.663  0.00  0.00    +0.026 A 
ENDBRANCH  12  18
ENDBRANCH  11  12
ENDBRANCH  10  11
ENDBRANCH   8  10
ENDBRANCH   1   8
BRANCH   2  21
ATOM     21  C   LIG    1        0.683  -2.627   1.725  0.00  0.00    +0.103 C 
ATOM     22  N   LIG    1        0.062  -3.376   2.359  0.00  0.00    -0.191 NA
ENDBRANCH   2  21
BRANCH   6  23
ATOM     23  N   LIG    1        3.516   1.110  -1.305  0.00  0.00    -0.283 N 
ATOM     24  H   LIG    1        2.785   1.663  -1.736  0.00  0.00    +0.155 HD
BRANCH  23  25
ATOM     25  C   LIG    1        4.808   1.397  -1.559  0.00  0.00    +0.146 A 
ATOM     26  N   LIG    1        5.898   0.790  -1.084  0.00  0.00    -0.158 NA
ATOM     27  N   LIG    1        6.925   1.450  -1.638  0.00  0.00    -0.280 N 
ATOM     28  H   LIG    1        7.867   1.149  -1.409  0.00  0.00    +0.189 HD
ATOM     29  C   LIG    1        6.543   2.471  -2.460  0.00  0.00    +0.035 A 
ATOM     30  C   LIG    1        7.515   3.327  -3.171  0.00  0.00    +0.065 C 
ATOM     31  C   LIG    1        5.166   2.459  -2.427  0.00  0.00    +0.068 A 
ENDBRANCH  23  25
ENDBRANCH   6  23
TORSDOF 8