REMARK  Name = BDB027864
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.644  -1.111   0.466  0.00  0.00    +0.130 A 
ATOM      2  C   LIG    1        1.333  -2.253   0.029  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.303  -2.032  -0.950  0.00  0.00    +0.095 A 
ATOM      4  C   LIG    1        2.999  -3.152  -1.379  0.00  0.00    +0.139 A 
ATOM      5  N   LIG    1        2.817  -4.426  -0.942  0.00  0.00    -0.261 NA
ATOM      6  C   LIG    1        1.862  -4.606  -0.013  0.00  0.00    +0.111 A 
ATOM      7  N   LIG    1        2.562  -0.821  -1.464  0.00  0.00    -0.226 NA
ATOM      8  C   LIG    1        1.828   0.205  -1.008  0.00  0.00    +0.162 A 
ATOM      9  C   LIG    1        1.104  -3.569   0.498  0.00  0.00    +0.033 A 
ATOM     10  N   LIG    1        0.885   0.100  -0.058  0.00  0.00    -0.212 NA
ENDROOT
BRANCH   8  11
ATOM     11  C   LIG    1        2.074   1.541  -1.581  0.00  0.00    +0.022 A 
ATOM     12  C   LIG    1        3.113   1.769  -2.496  0.00  0.00    +0.031 A 
ATOM     13  C   LIG    1        3.306   3.043  -3.008  0.00  0.00    +0.111 A 
ATOM     14  N   LIG    1        2.544   4.106  -2.680  0.00  0.00    -0.263 NA
ATOM     15  C   LIG    1        1.544   3.882  -1.805  0.00  0.00    +0.111 A 
ATOM     16  C   LIG    1        1.277   2.645  -1.240  0.00  0.00    +0.031 A 
ENDBRANCH   8  11
BRANCH   1  17
ATOM     17  N   LIG    1       -0.342  -1.242   1.468  0.00  0.00    -0.328 N 
ATOM     18  H   LIG    1        0.092  -1.683   2.275  0.00  0.00    +0.147 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -1.076  -0.031   1.858  0.00  0.00    +0.110 C 
BRANCH  19  21
ATOM     20  C   LIG    1       -2.345   0.294  -0.343  0.00  0.00    +0.014 C 
ATOM     21  C   LIG    1       -2.467   0.083   1.178  0.00  0.00    -0.007 C 
ATOM     22  C   LIG    1       -3.283  -1.205   1.426  0.00  0.00    +0.014 C 
BRANCH  21  23
ATOM     23  C   LIG    1       -3.262   1.264   1.807  0.00  0.00    +0.085 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -2.655   2.581   1.618  0.00  0.00    -0.329 NA
ATOM     25  H   LIG    1       -3.293   3.297   1.965  0.00  0.00    +0.118 HD
ATOM     26  H   LIG    1       -1.809   2.668   2.179  0.00  0.00    +0.118 HD
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH  19  21
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 6