REMARK  Name = BDB018481
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.423  -0.279  -0.526  0.00  0.00    +0.025 A 
ATOM      2  C   LIG    1        0.655  -0.757   0.188  0.00  0.00    +0.123 A 
ATOM      3  N   LIG    1        1.762  -0.689  -0.632  0.00  0.00    -0.239 N 
ATOM      4  N   LIG    1        1.415  -0.265  -1.878  0.00  0.00    -0.174 NA
ATOM      5  C   LIG    1        0.112   0.009  -1.793  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1       -2.642   0.972  -0.439  0.00  0.00    +0.135 A 
ATOM      7  C   LIG    1       -1.777  -0.157  -0.056  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -2.307  -1.093   0.759  0.00  0.00    +0.101 A 
ATOM      9  N   LIG    1       -3.608  -1.036   1.229  0.00  0.00    -0.317 N 
ATOM     10  C   LIG    1       -4.079  -2.105   2.096  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -4.473  -0.010   0.884  0.00  0.00    +0.255 A 
ATOM     12  O   LIG    1       -5.640   0.089   1.254  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -3.911   1.039  -0.001  0.00  0.00    +0.116 A 
BRANCH   6  14
ATOM     14  O   LIG    1       -2.027   1.915  -1.238  0.00  0.00    -0.491 OA
BRANCH  14  16
ATOM     15  C   LIG    1       -1.875   3.928  -2.502  0.00  0.00    +0.048 C 
ATOM     16  C   LIG    1       -2.776   3.061  -1.642  0.00  0.00    +0.226 C 
ENDBRANCH  14  16
ENDBRANCH   6  14
ENDBRANCH   1   7
BRANCH   3  17
ATOM     17  C   LIG    1        3.115  -1.044  -0.355  0.00  0.00    +0.077 A 
ATOM     18  C   LIG    1        3.638  -1.163   0.942  0.00  0.00    +0.062 A 
ATOM     19  C   LIG    1        4.948  -1.633   1.137  0.00  0.00    +0.015 A 
ATOM     20  C   LIG    1        5.757  -1.943   0.046  0.00  0.00    +0.001 A 
ATOM     21  C   LIG    1        5.267  -1.775  -1.246  0.00  0.00    +0.002 A 
ATOM     22  C   LIG    1        3.958  -1.327  -1.447  0.00  0.00    +0.028 A 
BRANCH  18  23
ATOM     23  C   LIG    1        2.955  -0.702   2.165  0.00  0.00    +0.244 C 
ATOM     24  O   LIG    1        2.703  -1.466   3.083  0.00  0.00    -0.270 OA
ATOM     25  N   LIG    1        2.667   0.632   2.213  0.00  0.00    -0.325 N 
ATOM     26  H   LIG    1        2.959   1.288   1.501  0.00  0.00    +0.145 HD
ATOM     27  H   LIG    1        2.259   0.997   3.064  0.00  0.00    +0.145 HD
ENDBRANCH  18  23
ENDBRANCH   3  17
TORSDOF 5