REMARK  Name = BDB060295
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.795   1.125   1.967  0.00  0.00    +0.219 A 
ATOM      2  N   LIG    1        0.175   0.549   0.869  0.00  0.00    -0.166 N 
ATOM      3  C   LIG    1       -1.193   0.327   0.659  0.00  0.00    +0.255 C 
ATOM      4  O   LIG    1       -1.994   0.618   1.543  0.00  0.00    -0.270 OA
ATOM      5  N   LIG    1        1.113   0.171  -0.044  0.00  0.00    -0.139 NA
ATOM      6  C   LIG    1        2.266   0.510   0.564  0.00  0.00    +0.202 A 
ATOM      7  N   LIG    1        2.091   1.091   1.801  0.00  0.00    -0.192 NA
ENDROOT
BRANCH   6   8
ATOM      8  C   LIG    1        3.598   0.288  -0.025  0.00  0.00    +0.110 A 
ATOM      9  N   LIG    1        4.673   0.643   0.726  0.00  0.00    -0.252 NA
ATOM     10  C   LIG    1        5.899   0.443   0.195  0.00  0.00    +0.111 A 
ATOM     11  C   LIG    1        6.116  -0.101  -1.059  0.00  0.00    +0.020 A 
ATOM     12  C   LIG    1        5.010  -0.462  -1.818  0.00  0.00    +0.004 A 
ATOM     13  C   LIG    1        3.732  -0.267  -1.298  0.00  0.00    +0.031 A 
ENDBRANCH   6   8
BRANCH   1  14
ATOM     14  N   LIG    1        0.142   1.638   3.027  0.00  0.00    -0.327 N 
ATOM     15  H   LIG    1       -0.842   1.412   3.177  0.00  0.00    +0.145 HD
ATOM     16  H   LIG    1        0.676   1.800   3.874  0.00  0.00    +0.145 HD
ENDBRANCH   1  14
BRANCH   3  17
ATOM     17  C   LIG    1       -1.506  -0.287  -0.687  0.00  0.00    +0.136 C 
BRANCH  17  18
ATOM     18  C   LIG    1       -2.985  -0.488  -0.929  0.00  0.00    -0.038 A 
ATOM     19  C   LIG    1       -3.608  -1.690  -0.564  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1       -4.976  -1.869  -0.777  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -5.733  -0.850  -1.351  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -5.125   0.351  -1.709  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -3.758   0.534  -1.498  0.00  0.00    +0.004 A 
ENDBRANCH  17  18
ENDBRANCH   3  17
TORSDOF 4