REMARK  Name = BDB018893
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.410   0.619  -0.387  0.00  0.00    +0.241 C 
ATOM      2  N   LIG    1       -1.082   0.335  -0.090  0.00  0.00    -0.269 N 
ATOM      3  C   LIG    1        0.020   0.584  -0.935  0.00  0.00    +0.040 A 
ATOM      4  C   LIG    1        1.211   0.181  -0.318  0.00  0.00    -0.017 A 
ATOM      5  C   LIG    1        2.449   0.310  -0.956  0.00  0.00    -0.010 A 
ATOM      6  C   LIG    1        2.450   0.870  -2.244  0.00  0.00    +0.009 A 
ATOM      7  C   LIG    1        1.258   1.278  -2.860  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        0.933  -0.429   1.022  0.00  0.00    +0.057 C 
ATOM      9  C   LIG    1        0.033   1.134  -2.205  0.00  0.00    +0.024 A 
ATOM     10  C   LIG    1       -0.568  -0.177   1.191  0.00  0.00    +0.118 C 
ATOM     11  O   LIG    1       -2.787   1.095  -1.460  0.00  0.00    -0.273 OA
ENDROOT
BRANCH   5  12
ATOM     12  C   LIG    1        3.696  -0.122  -0.334  0.00  0.00    +0.019 A 
ATOM     13  C   LIG    1        4.270   0.526   0.742  0.00  0.00    +0.124 A 
ATOM     14  N   LIG    1        5.415   0.137   1.343  0.00  0.00    -0.222 NA
ATOM     15  C   LIG    1        6.006  -0.953   0.847  0.00  0.00    +0.213 A 
ATOM     16  N   LIG    1        5.564  -1.647  -0.205  0.00  0.00    -0.222 NA
ATOM     17  C   LIG    1        4.414  -1.218  -0.768  0.00  0.00    +0.124 A 
BRANCH  15  18
ATOM     18  N   LIG    1        7.183  -1.363   1.434  0.00  0.00    -0.327 N 
ATOM     19  H   LIG    1        7.626  -0.579   1.891  0.00  0.00    +0.145 HD
ATOM     20  H   LIG    1        7.734  -1.882   0.764  0.00  0.00    +0.145 HD
ENDBRANCH  15  18
ENDBRANCH   5  12
BRANCH   1  22
ATOM     21  N   LIG    1       -4.716   1.017   0.597  0.00  0.00    -0.258 N 
ATOM     22  C   LIG    1       -3.440   0.244   0.698  0.00  0.00    +0.170 C 
ATOM     23  C   LIG    1       -3.883  -1.211   0.541  0.00  0.00    +0.034 C 
ATOM     24  C   LIG    1       -5.030  -1.115  -0.450  0.00  0.00    +0.022 C 
ATOM     25  C   LIG    1       -5.748   0.167  -0.051  0.00  0.00    +0.117 C 
BRANCH  21  27
ATOM     26  N   LIG    1       -4.859   3.497   0.837  0.00  0.00    -0.174 NA
ATOM     27  C   LIG    1       -4.794   2.349   0.707  0.00  0.00    +0.170 C 
ENDBRANCH  21  27
ENDBRANCH   1  22
TORSDOF 4