REMARK  Name = BDB002195
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.787   0.753   0.024  0.00  0.00    +0.032 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -2.096   0.459   0.749  0.00  0.00    +0.144 C 
BRANCH   2   8
ATOM      3  C   LIG    1       -5.905   2.420  -1.457  0.00  0.00    +0.070 C 
ATOM      4  C   LIG    1       -4.923   1.361  -1.110  0.00  0.00    +0.090 A 
ATOM      5  C   LIG    1       -4.852   0.018  -1.562  0.00  0.00    +0.169 A 
ATOM      6  C   LIG    1       -3.740  -0.526  -0.928  0.00  0.00    +0.067 A 
ATOM      7  C   LIG    1       -3.141  -1.886  -1.009  0.00  0.00    +0.067 C 
ATOM      8  N   LIG    1       -3.240   0.488  -0.149  0.00  0.00    -0.266 N 
ATOM      9  N   LIG    1       -3.938   1.635  -0.245  0.00  0.00    -0.174 NA
BRANCH   5  10
ATOM     10  N   LIG    1       -5.741  -0.645  -2.480  0.00  0.00    +0.060 N 
ATOM     11  O   LIG    1       -5.610  -1.868  -2.620  0.00  0.00    -0.126 OA
ATOM     12  O   LIG    1       -6.580   0.054  -3.061  0.00  0.00    -0.126 OA
ENDBRANCH   5  10
ENDBRANCH   2   8
ENDBRANCH   1   2
BRANCH   1  13
ATOM     13  C   LIG    1        0.386   0.789   1.000  0.00  0.00    +0.097 C 
BRANCH  13  14
ATOM     14  C   LIG    1        1.710   1.007   0.293  0.00  0.00    +0.213 C 
ATOM     15  N   LIG    1        2.763   1.152   1.168  0.00  0.00    -0.311 N 
ATOM     16  H   LIG    1        2.620   0.938   2.145  0.00  0.00    +0.149 HD
ATOM     17  O   LIG    1        1.827   1.038  -0.927  0.00  0.00    -0.276 OA
BRANCH  15  18
ATOM     18  C   LIG    1        4.130   1.234   0.705  0.00  0.00    +0.139 C 
BRANCH  18  19
ATOM     19  C   LIG    1        4.819  -0.098   0.851  0.00  0.00    -0.030 A 
ATOM     20  C   LIG    1        5.613  -0.378   1.973  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1        6.228  -1.623   2.110  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        6.052  -2.602   1.133  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        5.258  -2.338   0.018  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        4.643  -1.093  -0.121  0.00  0.00    +0.005 A 
ENDBRANCH  18  19
ENDBRANCH  15  18
ENDBRANCH  13  14
ENDBRANCH   1  13
TORSDOF 7