REMARK  Name = BDB014583
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.241  -0.440  -0.409  0.00  0.00    +0.136 C 
ENDROOT
BRANCH   1   4
ATOM      2  O   LIG    1       -2.502  -1.655  -1.554  0.00  0.00    -0.275 OA
ATOM      3  C   LIG    1       -2.670  -0.901  -0.601  0.00  0.00    +0.222 C 
ATOM      4  N   LIG    1       -1.611  -0.327   0.081  0.00  0.00    -0.312 N 
ATOM      5  H   LIG    1       -1.808   0.401   0.758  0.00  0.00    +0.149 HD
BRANCH   3   6
ATOM      6  C   LIG    1       -4.028  -0.536  -0.037  0.00  0.00    +0.123 C 
ATOM      7  C   LIG    1       -4.586   0.780  -0.497  0.00  0.00    -0.013 A 
ATOM      8  C   LIG    1       -5.946   0.610  -0.774  0.00  0.00    +0.031 A 
ATOM      9  C   LIG    1       -6.742   1.683  -1.131  0.00  0.00    +0.023 A 
ATOM     10  C   LIG    1       -6.145   2.938  -1.262  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1       -4.775   3.106  -1.010  0.00  0.00    +0.000 A 
ATOM     12  N   LIG    1       -6.404  -0.713  -0.541  0.00  0.00    -0.343 N 
ATOM     13  H   LIG    1       -7.066  -0.996  -1.260  0.00  0.00    +0.146 HD
ATOM     14  C   LIG    1       -3.985   2.024  -0.614  0.00  0.00    +0.006 A 
ATOM     15  C   LIG    1       -5.139  -1.478  -0.546  0.00  0.00    +0.119 C 
ENDBRANCH   3   6
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  C   LIG    1        0.360  -1.831  -0.146  0.00  0.00    +0.145 C 
BRANCH  16  17
ATOM     17  O   LIG    1        0.363  -2.108   1.263  0.00  0.00    -0.389 OA
ATOM     18  H   LIG    1       -0.555  -1.966   1.555  0.00  0.00    +0.210 HD
ENDBRANCH  16  17
BRANCH  16  19
ATOM     19  C   LIG    1        1.782  -1.983  -0.737  0.00  0.00    +0.117 C 
BRANCH  19  20
ATOM     20  N   LIG    1        2.739  -0.893  -0.439  0.00  0.00    -0.295 NA
ATOM     21  C   LIG    1        3.074  -0.854   1.002  0.00  0.00    +0.120 C 
ATOM     22  C   LIG    1        4.220   0.080   1.344  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1        5.117   0.523   0.358  0.00  0.00    -0.042 A 
ATOM     24  C   LIG    1        6.178   1.369   0.708  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1        6.364   1.751   2.036  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1        5.491   1.298   3.021  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1        4.898   0.135  -1.080  0.00  0.00    +0.051 C 
ATOM     28  C   LIG    1        4.425   0.465   2.678  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1        3.974  -1.082  -1.220  0.00  0.00    +0.089 C 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   1  16
TORSDOF 6