REMARK  Name = BDB014785
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.401  -0.749   0.116  0.00  0.00    +0.032 A 
ATOM      2  C   LIG    1       -0.442   0.169   0.746  0.00  0.00    +0.024 A 
ATOM      3  C   LIG    1       -1.828  -0.038   0.808  0.00  0.00    +0.010 A 
ATOM      4  C   LIG    1       -2.420  -1.174   0.240  0.00  0.00    -0.018 A 
ATOM      5  C   LIG    1       -1.577  -2.097  -0.391  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1       -0.193  -1.887  -0.452  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.875  -1.387   0.303  0.00  0.00    -0.018 A 
ATOM      8  C   LIG    1       -4.770  -0.405  -0.168  0.00  0.00    +0.015 A 
ATOM      9  C   LIG    1       -6.164  -0.581  -0.118  0.00  0.00    -0.016 A 
ATOM     10  C   LIG    1       -6.652  -1.790   0.410  0.00  0.00    +0.006 A 
ATOM     11  C   LIG    1       -5.785  -2.775   0.881  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1       -4.407  -2.572   0.829  0.00  0.00    +0.008 A 
BRANCH   9  13
ATOM     13  C   LIG    1       -7.150   0.467  -0.631  0.00  0.00    +0.085 C 
ATOM     14  C   LIG    1       -6.564   1.875  -0.808  0.00  0.00    +0.046 C 
ATOM     15  C   LIG    1       -7.777   0.009  -1.952  0.00  0.00    +0.046 C 
BRANCH  13  16
ATOM     16  O   LIG    1       -8.212   0.605   0.325  0.00  0.00    -0.385 OA
ATOM     17  H   LIG    1       -7.800   0.584   1.206  0.00  0.00    +0.211 HD
ENDBRANCH  13  16
ENDBRANCH   9  13
ENDBRANCH   4   7
BRANCH   1  18
ATOM     18  N   LIG    1        1.802  -0.597   0.018  0.00  0.00    -0.298 N 
ATOM     19  H   LIG    1        2.220  -1.384  -0.462  0.00  0.00    +0.154 HD
BRANCH  18  25
ATOM     20  C   LIG    1        8.574  -0.720  -1.327  0.00  0.00    +0.109 C 
ATOM     21  C   LIG    1        7.113  -1.082  -1.262  0.00  0.00    +0.213 C 
ATOM     22  N   LIG    1        6.296  -0.304  -0.450  0.00  0.00    -0.297 N 
ATOM     23  C   LIG    1        4.894  -0.750  -0.342  0.00  0.00    +0.148 C 
ATOM     24  C   LIG    1        4.041   0.317   0.243  0.00  0.00    +0.032 A 
ATOM     25  C   LIG    1        2.633   0.397   0.421  0.00  0.00    +0.150 A 
ATOM     26  N   LIG    1        2.305   1.550   1.018  0.00  0.00    -0.156 NA
ATOM     27  N   LIG    1        3.466   2.202   1.197  0.00  0.00    -0.269 N 
ATOM     28  C   LIG    1        3.446   3.511   1.803  0.00  0.00    +0.172 C 
ATOM     29  C   LIG    1        4.538   1.490   0.768  0.00  0.00    +0.047 A 
ATOM     30  C   LIG    1        5.971   1.861   0.805  0.00  0.00    +0.074 C 
ATOM     31  C   LIG    1        6.815   0.581   0.617  0.00  0.00    +0.114 C 
ATOM     32  O   LIG    1        6.680  -2.029  -1.920  0.00  0.00    -0.276 OA
ENDBRANCH  18  25
ENDBRANCH   1  18
TORSDOF 5