REMARK  Name = BDB007719
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.783  -1.046  -0.150  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   4
ATOM      2  O   LIG    1        1.096   0.576  -1.440  0.00  0.00    -0.270 OA
ATOM      3  C   LIG    1        1.424   0.015  -0.399  0.00  0.00    +0.244 C 
ATOM      4  N   LIG    1        0.558  -0.766   0.336  0.00  0.00    -0.309 N 
ATOM      5  H   LIG    1        0.934  -1.422   1.011  0.00  0.00    +0.149 HD
BRANCH   3   6
ATOM      6  C   LIG    1        2.820   0.120   0.110  0.00  0.00    +0.037 A 
ATOM      7  C   LIG    1        3.839   0.429  -0.799  0.00  0.00    +0.017 A 
ATOM      8  C   LIG    1        5.173   0.544  -0.375  0.00  0.00    -0.043 A 
ATOM      9  C   LIG    1        6.242   0.841  -1.398  0.00  0.00    +0.035 C 
ATOM     10  C   LIG    1        7.557   1.310  -0.777  0.00  0.00    +0.005 C 
ATOM     11  C   LIG    1        7.952   0.402   0.381  0.00  0.00    +0.005 C 
ATOM     12  C   LIG    1        6.902   0.464   1.489  0.00  0.00    +0.035 C 
ATOM     13  C   LIG    1        5.488   0.328   0.978  0.00  0.00    -0.044 A 
ATOM     14  C   LIG    1        4.460   0.044   1.889  0.00  0.00    +0.004 A 
ATOM     15  C   LIG    1        3.134  -0.059   1.461  0.00  0.00    +0.013 A 
ENDBRANCH   3   6
ENDBRANCH   1   4
BRANCH   1  16
ATOM     16  C   LIG    1       -1.593  -1.819   0.893  0.00  0.00    +0.145 C 
BRANCH  16  17
ATOM     17  O   LIG    1       -0.801  -2.946   1.333  0.00  0.00    -0.389 OA
ATOM     18  H   LIG    1       -0.687  -3.539   0.568  0.00  0.00    +0.210 HD
ENDBRANCH  16  17
BRANCH  16  19
ATOM     19  C   LIG    1       -2.957  -2.344   0.384  0.00  0.00    +0.117 C 
BRANCH  19  20
ATOM     20  N   LIG    1       -4.023  -1.426  -0.019  0.00  0.00    -0.295 NA
ATOM     21  C   LIG    1       -4.297  -0.365   0.958  0.00  0.00    +0.120 C 
ATOM     22  C   LIG    1       -5.436   0.546   0.548  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1       -5.860   0.617  -0.792  0.00  0.00    -0.042 A 
ATOM     24  C   LIG    1       -6.896   1.490  -1.149  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1       -7.490   2.308  -0.189  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -7.060   2.255   1.135  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -5.246  -0.293  -1.826  0.00  0.00    +0.051 C 
ATOM     28  C   LIG    1       -6.037   1.381   1.502  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1       -3.901  -0.879  -1.371  0.00  0.00    +0.089 C 
ENDBRANCH  19  20
ENDBRANCH  16  19
ENDBRANCH   1  16
TORSDOF 6