REMARK  Name = BDB018640
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.771   0.272   1.069  0.00  0.00    -0.268 N 
ATOM      2  H   LIG    1        2.146   1.208   1.060  0.00  0.00    +0.156 HD
ENDROOT
BRANCH   1   6
ATOM      3  C   LIG    1       -2.393   0.318   0.361  0.00  0.00    +0.048 A 
ATOM      4  C   LIG    1       -1.476  -0.433  -0.379  0.00  0.00    +0.136 A 
ATOM      5  N   LIG    1       -0.130  -0.476  -0.189  0.00  0.00    -0.238 NA
ATOM      6  C   LIG    1        0.392   0.260   0.805  0.00  0.00    +0.125 A 
ATOM      7  C   LIG    1       -0.430   1.049   1.604  0.00  0.00    +0.045 A 
ATOM      8  C   LIG    1       -1.811   1.074   1.379  0.00  0.00    +0.028 A 
BRANCH   3  13
ATOM      9  C   LIG    1       -7.866   0.278   0.397  0.00  0.00    +0.105 C 
ATOM     10  N   LIG    1       -6.695   0.318  -0.474  0.00  0.00    -0.302 NA
ATOM     11  C   LIG    1       -5.877  -0.902  -0.301  0.00  0.00    +0.103 C 
ATOM     12  C   LIG    1       -4.392  -0.731  -0.697  0.00  0.00    +0.120 C 
ATOM     13  N   LIG    1       -3.754   0.316   0.121  0.00  0.00    -0.326 N 
ATOM     14  C   LIG    1       -4.637   1.379   0.627  0.00  0.00    +0.120 C 
ATOM     15  C   LIG    1       -5.892   1.540  -0.264  0.00  0.00    +0.103 C 
ENDBRANCH   3  13
ENDBRANCH   1   6
BRANCH   1  16
ATOM     16  C   LIG    1        2.734  -0.556   0.493  0.00  0.00    +0.222 A 
ATOM     17  N   LIG    1        3.919   0.030   0.248  0.00  0.00    -0.199 NA
ATOM     18  C   LIG    1        4.908  -0.725  -0.279  0.00  0.00    +0.134 A 
ATOM     19  C   LIG    1        4.731  -2.063  -0.544  0.00  0.00    +0.064 A 
ATOM     20  C   LIG    1        3.498  -2.581  -0.239  0.00  0.00    +0.118 A 
ATOM     21  N   LIG    1        2.500  -1.857   0.287  0.00  0.00    -0.223 NA
BRANCH  18  22
ATOM     22  N   LIG    1        6.129  -0.074  -0.537  0.00  0.00    -0.238 N 
ATOM     23  C   LIG    1        7.279  -0.603  -1.124  0.00  0.00    +0.308 C 
ATOM     24  O   LIG    1        7.514  -1.741  -1.492  0.00  0.00    -0.252 OA
ATOM     25  N   LIG    1        8.211   0.426  -1.227  0.00  0.00    -0.297 N 
ATOM     26  H   LIG    1        9.170   0.192  -1.450  0.00  0.00    +0.150 HD
ATOM     27  C   LIG    1        7.777   1.577  -0.490  0.00  0.00    +0.125 C 
ATOM     28  C   LIG    1        6.287   1.343  -0.294  0.00  0.00    +0.135 C 
ENDBRANCH  18  22
ENDBRANCH   1  16
TORSDOF 4