REMARK  Name = BDB001879
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.290   0.368  -0.611  0.00  0.00    +0.057 C 
ATOM      2  C   LIG    1       -0.846  -0.176   0.672  0.00  0.00    -0.000 A 
ATOM      3  C   LIG    1       -2.110  -0.782   0.607  0.00  0.00    -0.036 A 
ATOM      4  C   LIG    1       -2.686  -1.335   1.756  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -2.019  -1.260   2.976  0.00  0.00    +0.000 A 
ATOM      6  C   LIG    1       -0.773  -0.642   3.050  0.00  0.00    +0.001 A 
ATOM      7  C   LIG    1       -2.803  -0.869  -0.724  0.00  0.00    +0.065 C 
ATOM      8  C   LIG    1       -2.474   0.355  -1.597  0.00  0.00    +0.061 C 
ATOM      9  C   LIG    1       -2.931   0.081  -3.037  0.00  0.00    +0.036 C 
ATOM     10  C   LIG    1       -3.168   1.630  -1.092  0.00  0.00    +0.036 C 
ATOM     11  C   LIG    1       -0.185  -0.101   1.903  0.00  0.00    +0.010 A 
ATOM     12  N   LIG    1       -1.024   0.604  -1.653  0.00  0.00    -0.280 NA
ENDROOT
BRANCH   1  13
ATOM     13  C   LIG    1        1.194   0.704  -0.757  0.00  0.00    +0.143 C 
ATOM     14  C   LIG    1        1.466   2.104  -0.203  0.00  0.00    +0.026 C 
BRANCH  13  15
ATOM     15  C   LIG    1        2.139  -0.370  -0.258  0.00  0.00    +0.316 C 
ATOM     16  O   LIG    1        1.856  -1.556  -0.155  0.00  0.00    -0.250 OA
BRANCH  15  17
ATOM     17  O   LIG    1        3.373   0.145   0.008  0.00  0.00    -0.464 OA
BRANCH  17  19
ATOM     18  C   LIG    1        5.643  -0.096   0.710  0.00  0.00    +0.048 C 
ATOM     19  C   LIG    1        4.339  -0.821   0.441  0.00  0.00    +0.229 C 
ENDBRANCH  17  19
ENDBRANCH  15  17
ENDBRANCH  13  15
ENDBRANCH   1  13
TORSDOF 4