REMARK  Name = BDB014377
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.613   0.473  -0.154  0.00  0.00    +0.197 A 
ATOM      2  N   LIG    1       -2.342   1.635  -0.186  0.00  0.00    -0.326 N 
ATOM      3  H   LIG    1       -1.962   2.553  -0.347  0.00  0.00    +0.169 HD
ATOM      4  C   LIG    1       -3.667   1.333  -0.009  0.00  0.00    +0.068 A 
ATOM      5  C   LIG    1       -3.689  -0.054   0.110  0.00  0.00    +0.103 A 
ATOM      6  C   LIG    1       -4.926  -0.702   0.302  0.00  0.00    +0.064 A 
ATOM      7  C   LIG    1       -6.091   0.085   0.365  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1       -6.030   1.476   0.240  0.00  0.00    +0.003 A 
ATOM      9  C   LIG    1       -4.811   2.132   0.048  0.00  0.00    +0.028 A 
ATOM     10  N   LIG    1       -2.406  -0.562   0.005  0.00  0.00    -0.214 NA
ENDROOT
BRANCH   1  14
ATOM     11  N   LIG    1        2.634   0.292  -0.331  0.00  0.00    -0.297 N 
ATOM     12  C   LIG    1        1.818  -0.724  -1.007  0.00  0.00    +0.127 C 
ATOM     13  C   LIG    1        0.406  -0.840  -0.393  0.00  0.00    +0.127 C 
ATOM     14  N   LIG    1       -0.269   0.467  -0.320  0.00  0.00    -0.298 N 
ATOM     15  C   LIG    1        0.572   1.624   0.027  0.00  0.00    +0.127 C 
ATOM     16  C   LIG    1        1.957   1.215   0.578  0.00  0.00    +0.127 C 
BRANCH  11  20
ATOM     17  C   LIG    1        6.645  -0.440   0.234  0.00  0.00    +0.088 A 
ATOM     18  C   LIG    1        5.889  -1.134  -0.675  0.00  0.00    +0.134 A 
ATOM     19  N   LIG    1        4.570  -0.915  -0.869  0.00  0.00    -0.221 NA
ATOM     20  C   LIG    1        3.970   0.036  -0.130  0.00  0.00    +0.218 A 
ATOM     21  N   LIG    1        4.643   0.762   0.781  0.00  0.00    -0.221 NA
ATOM     22  C   LIG    1        5.961   0.511   0.946  0.00  0.00    +0.134 A 
BRANCH  17  24
ATOM     23  N   LIG    1        9.164  -0.885   0.578  0.00  0.00    -0.191 NA
ATOM     24  C   LIG    1        8.032  -0.685   0.422  0.00  0.00    +0.102 C 
ENDBRANCH  17  24
ENDBRANCH  11  20
ENDBRANCH   1  14
BRANCH   6  25
ATOM     25  C   LIG    1       -5.033  -2.173   0.437  0.00  0.00    +0.244 C 
ATOM     26  O   LIG    1       -6.114  -2.725   0.605  0.00  0.00    -0.270 OA
ATOM     27  N   LIG    1       -3.877  -2.896   0.367  0.00  0.00    -0.325 N 
ATOM     28  H   LIG    1       -2.980  -2.436   0.223  0.00  0.00    +0.145 HD
ATOM     29  H   LIG    1       -3.919  -3.900   0.451  0.00  0.00    +0.145 HD
ENDBRANCH   6  25
TORSDOF 4