REMARK  Name = BDB007714
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.812  -3.385  -1.094  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   4
ATOM      2  O   LIG    1        2.164  -1.706  -2.948  0.00  0.00    -0.268 OA
ATOM      3  C   LIG    1        1.827  -1.252  -1.857  0.00  0.00    +0.265 C 
ATOM      4  N   LIG    1        1.287  -2.036  -0.853  0.00  0.00    -0.308 N 
ATOM      5  H   LIG    1        0.787  -1.535  -0.120  0.00  0.00    +0.149 HD
BRANCH   3   6
ATOM      6  C   LIG    1        1.948   0.176  -1.503  0.00  0.00    +0.154 A 
ATOM      7  C   LIG    1        2.252   0.744  -0.222  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1        2.201   2.120  -0.414  0.00  0.00    +0.066 A 
ATOM      9  C   LIG    1        2.428   3.049   0.607  0.00  0.00    +0.028 A 
ATOM     10  C   LIG    1        2.730   2.543   1.874  0.00  0.00    +0.002 A 
ATOM     11  C   LIG    1        2.805   1.170   2.101  0.00  0.00    +0.001 A 
ATOM     12  N   LIG    1        1.897   2.285  -1.735  0.00  0.00    -0.276 N 
ATOM     13  H   LIG    1        1.774   3.158  -2.232  0.00  0.00    +0.189 HD
ATOM     14  C   LIG    1        2.572   0.259   1.064  0.00  0.00    +0.012 A 
ATOM     15  N   LIG    1        1.760   1.144  -2.423  0.00  0.00    -0.168 NA
ENDBRANCH   3   6
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  C   LIG    1       -0.725  -3.481  -1.215  0.00  0.00    +0.145 C 
BRANCH  16  17
ATOM     17  O   LIG    1       -1.188  -2.826  -2.396  0.00  0.00    -0.389 OA
ATOM     18  H   LIG    1       -2.134  -3.021  -2.499  0.00  0.00    +0.210 HD
ENDBRANCH  16  17
BRANCH  16  19
ATOM     19  C   LIG    1       -1.485  -2.986   0.047  0.00  0.00    +0.117 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -1.193  -1.605   0.504  0.00  0.00    -0.295 NA
ATOM     21  C   LIG    1       -1.736  -0.596  -0.440  0.00  0.00    +0.120 C 
ATOM     22  C   LIG    1       -1.635   0.828   0.067  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1       -1.476   1.103   1.435  0.00  0.00    -0.042 A 
ATOM     24  C   LIG    1       -1.406   2.432   1.875  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1       -1.523   3.483   0.966  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -1.701   3.215  -0.389  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -1.313  -0.029   2.413  0.00  0.00    +0.051 C 
ATOM     28  C   LIG    1       -1.757   1.895  -0.837  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1       -1.778  -1.373   1.838  0.00  0.00    +0.089 C 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   1  16
TORSDOF 6