REMARK  Name = BDB012307
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.345  -1.685  -0.216  0.00  0.00    -0.182 N 
ATOM      2  C   LIG    1       -0.034  -1.913  -0.211  0.00  0.00    +0.220 A 
ATOM      3  C   LIG    1       -0.194  -3.276  -0.361  0.00  0.00    +0.088 A 
ATOM      4  C   LIG    1        1.104  -3.797  -0.436  0.00  0.00    +0.138 A 
ATOM      5  N   LIG    1        2.041  -2.857  -0.343  0.00  0.00    -0.170 NA
ENDROOT
BRANCH   1   8
ATOM      6  C   LIG    1        4.089   0.789  -0.005  0.00  0.00    +0.064 A 
ATOM      7  C   LIG    1        3.429  -0.433  -0.133  0.00  0.00    +0.063 A 
ATOM      8  C   LIG    1        2.038  -0.432  -0.106  0.00  0.00    +0.158 A 
ATOM      9  N   LIG    1        1.324   0.719   0.023  0.00  0.00    -0.236 NA
ATOM     10  C   LIG    1        1.994   1.886   0.118  0.00  0.00    +0.114 A 
ATOM     11  C   LIG    1        3.370   1.976   0.111  0.00  0.00    +0.035 A 
BRANCH   6  13
ATOM     12  O   LIG    1        6.221   0.169  -0.839  0.00  0.00    -0.245 OA
ATOM     13  C   LIG    1        5.565   0.801  -0.033  0.00  0.00    +0.337 C 
BRANCH  13  14
ATOM     14  O   LIG    1        6.097   1.563   0.945  0.00  0.00    -0.477 OA
ATOM     15  H   LIG    1        5.462   1.865   1.622  0.00  0.00    +0.295 HD
ENDBRANCH  13  14
ENDBRANCH   6  13
ENDBRANCH   1   8
BRANCH   2  16
ATOM     16  O   LIG    1       -0.906  -0.907  -0.076  0.00  0.00    -0.471 OA
BRANCH  16  17
ATOM     17  C   LIG    1       -2.291  -1.237  -0.175  0.00  0.00    +0.266 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -3.141   0.009  -0.061  0.00  0.00    -0.010 A 
ATOM     19  C   LIG    1       -2.687   1.250  -0.532  0.00  0.00    +0.007 A 
ATOM     20  C   LIG    1       -3.501   2.381  -0.456  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -4.782   2.284   0.082  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -5.252   1.056   0.541  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -4.439  -0.077   0.466  0.00  0.00    +0.007 A 
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   2  16
TORSDOF 6