REMARK  Name = BDB007833
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.012   0.767   0.264  0.00  0.00    +0.036 A 
ATOM      2  C   LIG    1       -0.681  -0.458   0.157  0.00  0.00    +0.051 A 
ATOM      3  C   LIG    1       -2.027  -0.484   0.468  0.00  0.00    +0.071 A 
ATOM      4  N   LIG    1       -2.937  -1.549   0.452  0.00  0.00    -0.295 N 
ATOM      5  C   LIG    1       -4.206  -1.079   0.852  0.00  0.00    +0.330 A 
ATOM      6  N   LIG    1       -4.047   0.300   1.112  0.00  0.00    -0.295 N 
ATOM      7  C   LIG    1       -5.083   1.190   1.547  0.00  0.00    +0.154 C 
ATOM      8  O   LIG    1       -5.234  -1.730   0.953  0.00  0.00    -0.246 OA
ATOM      9  C   LIG    1       -2.622  -2.900   0.086  0.00  0.00    +0.154 C 
ATOM     10  C   LIG    1       -2.715   0.659   0.876  0.00  0.00    +0.070 A 
ATOM     11  C   LIG    1       -2.087   1.877   0.991  0.00  0.00    +0.030 A 
ATOM     12  C   LIG    1       -0.721   1.922   0.679  0.00  0.00    +0.025 A 
ENDROOT
BRANCH   1  14
ATOM     13  C   LIG    1        2.262  -0.030  -0.442  0.00  0.00    +0.234 C 
ATOM     14  N   LIG    1        1.360   0.937  -0.022  0.00  0.00    -0.284 N 
ATOM     15  H   LIG    1        1.724   1.874   0.097  0.00  0.00    +0.155 HD
ATOM     16  O   LIG    1        2.010  -1.216  -0.648  0.00  0.00    -0.274 OA
BRANCH  13  17
ATOM     17  C   LIG    1        3.684   0.544  -0.665  0.00  0.00    +0.137 C 
ATOM     18  C   LIG    1        3.732   1.235  -2.026  0.00  0.00    +0.034 C 
BRANCH  17  20
ATOM     19  C   LIG    1        4.966  -0.989   0.720  0.00  0.00    +0.101 C 
ATOM     20  N   LIG    1        4.702  -0.526  -0.639  0.00  0.00    -0.309 NA
ATOM     21  H   LIG    1        4.325  -1.316  -1.175  0.00  0.00    +0.122 HD
ENDBRANCH  17  20
ENDBRANCH  13  17
ENDBRANCH   1  14
TORSDOF 3