REMARK  Name = BDB004718
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.106   1.078   0.467  0.00  0.00    -0.259 NA
ATOM      2  C   LIG    1        0.899   0.564  -0.148  0.00  0.00    +0.124 C 
ATOM      3  C   LIG    1        2.260   0.691   0.468  0.00  0.00    +0.017 C 
ATOM      4  C   LIG    1        3.394   0.585  -0.528  0.00  0.00    +0.162 C 
ATOM      5  C   LIG    1        4.732   0.407   0.145  0.00  0.00    +0.000 C 
ATOM      6  C   LIG    1        4.907   0.496   1.476  0.00  0.00    -0.025 C 
ATOM      7  C   LIG    1        3.784   0.758   2.443  0.00  0.00    +0.054 C 
ATOM      8  N   LIG    1        3.235  -0.495  -1.527  0.00  0.00    -0.264 NA
ATOM      9  C   LIG    1        2.013  -0.710  -1.872  0.00  0.00    +0.182 C 
ATOM     10  C   LIG    1        2.427   0.781   1.799  0.00  0.00    -0.014 C 
ATOM     11  N   LIG    1        0.909  -0.142  -1.318  0.00  0.00    -0.291 N 
ATOM     12  H   LIG    1        0.008  -0.288  -1.777  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1  13
ATOM     13  C   LIG    1       -1.511   1.001   0.032  0.00  0.00    +0.151 C 
BRANCH  13  14
ATOM     14  C   LIG    1       -2.269  -0.236   0.505  0.00  0.00    -0.022 A 
ATOM     15  C   LIG    1       -3.675  -0.250   0.449  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1       -4.401  -1.373   0.853  0.00  0.00    +0.000 A 
ATOM     17  C   LIG    1       -3.734  -2.500   1.325  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1       -2.344  -2.501   1.400  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -1.617  -1.377   0.996  0.00  0.00    +0.006 A 
ENDBRANCH  13  14
BRANCH  13  20
ATOM     20  C   LIG    1       -1.731   1.330  -1.478  0.00  0.00    +0.112 C 
BRANCH  20  22
ATOM     21  C   LIG    1       -1.779   0.573  -3.774  0.00  0.00    +0.101 C 
ATOM     22  N   LIG    1       -1.532   0.172  -2.390  0.00  0.00    -0.317 NA
ATOM     23  H   LIG    1       -2.226  -0.542  -2.135  0.00  0.00    +0.122 HD
ENDBRANCH  20  22
ENDBRANCH  13  20
ENDBRANCH   1  13
TORSDOF 4