REMARK  Name = BDB011456
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.856  -1.020  -0.660  0.00  0.00    -0.264 N 
ATOM      2  C   LIG    1       -2.172   0.321  -1.047  0.00  0.00    +0.078 A 
ATOM      3  C   LIG    1       -1.188   1.159  -1.601  0.00  0.00    +0.143 A 
ATOM      4  C   LIG    1       -1.495   2.456  -2.018  0.00  0.00    +0.047 A 
ATOM      5  C   LIG    1       -2.780   2.960  -1.843  0.00  0.00    +0.004 A 
ATOM      6  C   LIG    1       -3.762   2.155  -1.274  0.00  0.00    +0.002 A 
ATOM      7  O   LIG    1        0.061   0.703  -1.919  0.00  0.00    -0.481 OA
ATOM      8  C   LIG    1        0.955   0.432  -0.807  0.00  0.00    +0.141 C 
ATOM      9  C   LIG    1        1.698   1.741  -0.477  0.00  0.00    +0.078 C 
ATOM     10  C   LIG    1        2.452   2.288  -1.688  0.00  0.00    +0.164 C 
ATOM     11  O   LIG    1        2.936   1.279  -2.571  0.00  0.00    -0.379 OA
ATOM     12  C   LIG    1        3.244   0.062  -1.909  0.00  0.00    +0.164 C 
ATOM     13  C   LIG    1        1.979  -0.597  -1.362  0.00  0.00    +0.078 C 
ATOM     14  C   LIG    1        0.216  -0.124   0.439  0.00  0.00    +0.204 C 
ATOM     15  C   LIG    1       -3.462   0.844  -0.887  0.00  0.00    +0.027 A 
ATOM     16  C   LIG    1       -0.667  -1.314   0.022  0.00  0.00    +0.244 C 
ATOM     17  O   LIG    1       -0.334  -2.468   0.319  0.00  0.00    -0.273 OA
ENDROOT
BRANCH  14  18
ATOM     18  N   LIG    1        1.106  -0.580   1.510  0.00  0.00    -0.300 N 
ATOM     19  H   LIG    1        1.358  -1.569   1.544  0.00  0.00    +0.150 HD
ATOM     20  C   LIG    1        1.476   0.190   2.586  0.00  0.00    +0.230 C 
ATOM     21  O   LIG    1        1.159   1.369   2.705  0.00  0.00    -0.274 OA
BRANCH  20  22
ATOM     22  C   LIG    1        2.280  -0.594   3.647  0.00  0.00    +0.135 C 
ATOM     23  C   LIG    1        3.085   0.341   4.541  0.00  0.00    +0.033 C 
BRANCH  22  24
ATOM     24  N   LIG    1        3.167  -1.578   2.986  0.00  0.00    -0.320 NA
ATOM     25  H   LIG    1        3.669  -2.100   3.705  0.00  0.00    +0.119 HD
ATOM     26  H   LIG    1        3.885  -1.070   2.467  0.00  0.00    +0.119 HD
ENDBRANCH  22  24
ENDBRANCH  20  22
ENDBRANCH  14  18
BRANCH   1  28
ATOM     27  C   LIG    1       -3.597  -2.047  -2.209  0.00  0.00    +0.028 C 
ATOM     28  C   LIG    1       -2.780  -2.143  -0.916  0.00  0.00    +0.076 C 
ATOM     29  C   LIG    1       -3.660  -2.463   0.295  0.00  0.00    +0.028 C 
ENDBRANCH   1  28
TORSDOF 4