REMARK  Name = BDB018492
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.113  -1.764  -0.677  0.00  0.00    +0.022 A 
ATOM      2  C   LIG    1        0.963  -1.179  -0.050  0.00  0.00    +0.123 A 
ATOM      3  N   LIG    1        1.813  -0.730  -1.037  0.00  0.00    -0.239 N 
ATOM      4  N   LIG    1        1.425  -1.229  -2.250  0.00  0.00    -0.174 NA
ATOM      5  C   LIG    1        0.246  -1.812  -2.027  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1       -2.330  -1.126   0.341  0.00  0.00    -0.003 A 
ATOM      7  C   LIG    1       -1.338  -2.154  -0.051  0.00  0.00    +0.009 A 
ATOM      8  C   LIG    1       -1.621  -3.448   0.182  0.00  0.00    +0.098 A 
ATOM      9  N   LIG    1       -2.805  -3.852   0.773  0.00  0.00    -0.318 N 
ATOM     10  C   LIG    1       -3.019  -5.274   0.994  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -3.787  -2.948   1.159  0.00  0.00    +0.252 A 
ATOM     12  O   LIG    1       -4.861  -3.247   1.674  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -3.486  -1.516   0.909  0.00  0.00    +0.079 A 
BRANCH   6  19
ATOM     14  C   LIG    1       -1.184   4.361  -0.813  0.00  0.00    +0.152 C 
ATOM     15  N   LIG    1       -1.528   2.996  -0.453  0.00  0.00    -0.318 N 
ATOM     16  C   LIG    1       -0.831   2.368   0.573  0.00  0.00    +0.252 A 
ATOM     17  O   LIG    1        0.123   2.850   1.184  0.00  0.00    -0.268 OA
ATOM     18  C   LIG    1       -1.258   0.982   0.896  0.00  0.00    +0.078 A 
ATOM     19  C   LIG    1       -2.121   0.314   0.108  0.00  0.00    -0.011 A 
ATOM     20  C   LIG    1       -2.752   1.036  -0.984  0.00  0.00    +0.026 A 
ATOM     21  C   LIG    1       -2.460   2.321  -1.220  0.00  0.00    +0.089 A 
ENDBRANCH   6  19
ENDBRANCH   1   7
BRANCH   3  22
ATOM     22  C   LIG    1        2.879   0.225  -0.975  0.00  0.00    +0.077 A 
ATOM     23  C   LIG    1        3.326   0.857   0.199  0.00  0.00    +0.063 A 
ATOM     24  C   LIG    1        4.299   1.875   0.134  0.00  0.00    +0.015 A 
ATOM     25  C   LIG    1        4.840   2.266  -1.089  0.00  0.00    +0.001 A 
ATOM     26  C   LIG    1        4.425   1.635  -2.254  0.00  0.00    +0.002 A 
ATOM     27  C   LIG    1        3.457   0.628  -2.200  0.00  0.00    +0.028 A 
BRANCH  23  28
ATOM     28  C   LIG    1        2.950   0.458   1.565  0.00  0.00    +0.259 C 
ATOM     29  N   LIG    1        2.250   1.451   2.286  0.00  0.00    -0.219 N 
ATOM     30  H   LIG    1        1.751   2.203   1.784  0.00  0.00    +0.167 HD
ATOM     31  O   LIG    1        3.278  -0.636   1.998  0.00  0.00    -0.269 OA
BRANCH  29  32
ATOM     32  C   LIG    1        1.825   1.039   3.479  0.00  0.00    +0.173 C 
ATOM     33  N   LIG    1        1.403   0.716   4.508  0.00  0.00    -0.174 NA
ENDBRANCH  29  32
ENDBRANCH  23  28
ENDBRANCH   3  22
TORSDOF 5