REMARK  Name = BDB036923
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.612   0.361   0.578  0.00  0.00    -0.216 N 
ATOM      2  C   LIG    1       -0.580   0.274   1.962  0.00  0.00    +0.268 A 
ATOM      3  O   LIG    1       -1.568   0.159   2.683  0.00  0.00    -0.266 OA
ATOM      4  C   LIG    1        0.755   0.336   2.582  0.00  0.00    +0.075 A 
ATOM      5  C   LIG    1        1.852   0.386   1.828  0.00  0.00    +0.050 A 
ATOM      6  C   LIG    1        1.691   0.361   0.356  0.00  0.00    +0.140 A 
ATOM      7  N   LIG    1        0.517   0.350  -0.216  0.00  0.00    -0.153 NA
ENDROOT
BRANCH   1  14
ATOM      8  O   LIG    1       -6.006   0.146  -0.492  0.00  0.00    -0.275 OA
ATOM      9  C   LIG    1       -4.787   0.167  -0.353  0.00  0.00    +0.219 C 
ATOM     10  N   LIG    1       -4.147   1.282   0.125  0.00  0.00    -0.255 N 
ATOM     11  H   LIG    1       -4.739   2.061   0.379  0.00  0.00    +0.158 HD
ATOM     12  C   LIG    1       -2.792   1.489   0.276  0.00  0.00    +0.244 C 
ATOM     13  O   LIG    1       -2.379   2.593   0.630  0.00  0.00    -0.273 OA
ATOM     14  C   LIG    1       -1.890   0.316  -0.131  0.00  0.00    +0.197 C 
ATOM     15  C   LIG    1       -2.615  -1.020   0.024  0.00  0.00    +0.045 C 
ATOM     16  C   LIG    1       -3.909  -0.989  -0.772  0.00  0.00    +0.099 C 
ENDBRANCH   1  14
BRANCH   6  17
ATOM     17  N   LIG    1        2.772   0.352  -0.488  0.00  0.00    -0.326 N 
ATOM     18  H   LIG    1        2.489   0.215  -1.460  0.00  0.00    +0.148 HD
BRANCH  17  19
ATOM     19  C   LIG    1        4.059  -0.244  -0.182  0.00  0.00    +0.130 C 
BRANCH  19  20
ATOM     20  C   LIG    1        4.939  -0.244  -1.437  0.00  0.00    +0.174 C 
BRANCH  20  21
ATOM     21  O   LIG    1        4.309  -0.969  -2.494  0.00  0.00    -0.393 OA
ATOM     22  H   LIG    1        4.201  -1.891  -2.201  0.00  0.00    +0.209 HD
ENDBRANCH  20  21
ENDBRANCH  19  20
ENDBRANCH  17  19
ENDBRANCH   6  17
TORSDOF 5