REMARK  Name = BDB002344
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.322  -0.893  -0.613  0.00  0.00    +0.159 C 
ATOM      2  C   LIG    1       -0.280  -0.181  -1.506  0.00  0.00    +0.236 C 
ATOM      3  O   LIG    1        0.031   1.004  -1.336  0.00  0.00    -0.274 OA
ATOM      4  N   LIG    1        0.296  -0.922  -2.530  0.00  0.00    -0.291 N 
ATOM      5  C   LIG    1        0.154  -2.370  -2.648  0.00  0.00    +0.108 C 
ATOM      6  C   LIG    1       -1.230  -2.761  -3.160  0.00  0.00    +0.019 C 
ATOM      7  C   LIG    1       -2.320  -2.719  -2.091  0.00  0.00    +0.004 C 
ATOM      8  C   LIG    1       -2.527  -1.352  -1.437  0.00  0.00    +0.032 C 
ENDROOT
BRANCH   1  10
ATOM      9  C   LIG    1       -1.366  -0.056   1.728  0.00  0.00    +0.230 C 
ATOM     10  N   LIG    1       -1.750   0.055   0.407  0.00  0.00    -0.303 N 
ATOM     11  H   LIG    1       -1.989   1.002   0.119  0.00  0.00    +0.149 HD
ATOM     12  O   LIG    1       -0.867  -1.075   2.198  0.00  0.00    -0.274 OA
BRANCH   9  13
ATOM     13  C   LIG    1       -1.579   1.250   2.537  0.00  0.00    +0.137 C 
ATOM     14  C   LIG    1       -1.649   0.943   4.031  0.00  0.00    +0.034 C 
BRANCH  13  16
ATOM     15  C   LIG    1       -2.878   3.322   2.490  0.00  0.00    +0.101 C 
ATOM     16  N   LIG    1       -2.790   1.944   2.029  0.00  0.00    -0.309 NA
ATOM     17  H   LIG    1       -3.615   1.425   2.333  0.00  0.00    +0.122 HD
ENDBRANCH  13  16
ENDBRANCH   9  13
ENDBRANCH   1  10
BRANCH   4  18
ATOM     18  C   LIG    1        1.310  -0.266  -3.358  0.00  0.00    +0.205 C 
BRANCH  18  19
ATOM     19  C   LIG    1        2.659  -0.309  -2.647  0.00  0.00    +0.246 C 
ATOM     20  N   LIG    1        2.869   0.778  -1.805  0.00  0.00    -0.235 N 
ATOM     21  H   LIG    1        2.034   1.262  -1.458  0.00  0.00    +0.173 HD
ATOM     22  O   LIG    1        3.436  -1.260  -2.736  0.00  0.00    -0.273 OA
BRANCH  20  23
ATOM     23  N   LIG    1        3.934   0.636  -0.869  0.00  0.00    -0.264 N 
ATOM     24  H   LIG    1        4.432  -0.243  -1.063  0.00  0.00    +0.170 HD
BRANCH  23  25
ATOM     25  C   LIG    1        3.434   0.637   0.459  0.00  0.00    +0.044 A 
ATOM     26  C   LIG    1        2.935   1.821   1.022  0.00  0.00    +0.024 A 
ATOM     27  C   LIG    1        2.406   1.825   2.314  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1        2.361   0.641   3.050  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        2.843  -0.545   2.495  0.00  0.00    +0.002 A 
ATOM     30  C   LIG    1        3.378  -0.547   1.204  0.00  0.00    +0.024 A 
ENDBRANCH  23  25
ENDBRANCH  20  23
ENDBRANCH  18  19
ENDBRANCH   4  18
TORSDOF 7