REMARK  Name = BDB060432
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.180   0.726   0.096  0.00  0.00    -0.281 N 
ATOM      2  H   LIG    1       -0.187   0.421  -0.869  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1        1.057   0.897   0.690  0.00  0.00    +0.248 C 
ATOM      4  O   LIG    1        1.282   1.100   1.876  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1  14
ATOM      5  C   LIG    1       -3.999  -2.528  -2.548  0.00  0.00    +0.129 C 
ATOM      6  N   LIG    1       -3.995  -1.503  -1.534  0.00  0.00    -0.302 N 
ATOM      7  H   LIG    1       -3.628  -1.771  -0.631  0.00  0.00    +0.150 HD
ATOM      8  C   LIG    1       -5.047  -0.622  -1.448  0.00  0.00    +0.306 C 
ATOM      9  N   LIG    1       -5.023   0.242  -0.347  0.00  0.00    -0.255 N 
ATOM     10  C   LIG    1       -3.876   0.603   0.435  0.00  0.00    +0.043 A 
ATOM     11  C   LIG    1       -4.048   1.103   1.738  0.00  0.00    -0.026 A 
ATOM     12  C   LIG    1       -2.931   1.403   2.530  0.00  0.00    +0.007 A 
ATOM     13  C   LIG    1       -1.639   1.266   2.019  0.00  0.00    +0.024 A 
ATOM     14  C   LIG    1       -1.447   0.843   0.708  0.00  0.00    +0.035 A 
ATOM     15  C   LIG    1       -5.428   1.309   2.299  0.00  0.00    +0.038 C 
ATOM     16  C   LIG    1       -6.336   1.769   1.175  0.00  0.00    +0.024 C 
ATOM     17  C   LIG    1       -2.568   0.527  -0.074  0.00  0.00    +0.047 A 
ATOM     18  C   LIG    1       -6.340   0.730   0.067  0.00  0.00    +0.115 C 
ATOM     19  O   LIG    1       -5.983  -0.664  -2.245  0.00  0.00    -0.252 OA
ENDBRANCH   1  14
BRANCH   3  20
ATOM     20  C   LIG    1        2.218   0.765  -0.236  0.00  0.00    +0.038 A 
ATOM     21  C   LIG    1        3.394   0.175   0.253  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1        4.514   0.022  -0.576  0.00  0.00    +0.003 A 
ATOM     23  C   LIG    1        4.433   0.480  -1.901  0.00  0.00    +0.010 A 
ATOM     24  C   LIG    1        3.272   1.088  -2.385  0.00  0.00    +0.001 A 
ATOM     25  C   LIG    1        2.164   1.236  -1.553  0.00  0.00    +0.013 A 
BRANCH  22  26
ATOM     26  C   LIG    1        5.747  -0.600  -0.079  0.00  0.00    +0.093 A 
ATOM     27  N   LIG    1        6.739  -0.959  -0.914  0.00  0.00    -0.171 NA
ATOM     28  N   LIG    1        7.685  -1.483  -0.118  0.00  0.00    -0.274 N 
ATOM     29  C   LIG    1        8.908  -1.976  -0.703  0.00  0.00    +0.172 C 
ATOM     30  C   LIG    1        7.352  -1.479   1.200  0.00  0.00    +0.108 A 
ATOM     31  C   LIG    1        6.102  -0.912   1.264  0.00  0.00    +0.049 A 
ENDBRANCH  22  26
ENDBRANCH   3  20
TORSDOF 3