REMARK  Name = BDB002063
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.486  -2.114   0.842  0.00  0.00    -0.282 N 
ATOM      2  H   LIG    1       -0.364  -2.723   1.645  0.00  0.00    +0.155 HD
ATOM      3  C   LIG    1        0.719  -1.925   0.224  0.00  0.00    +0.255 C 
ATOM      4  O   LIG    1        1.675  -2.574   0.660  0.00  0.00    -0.272 OA
ENDROOT
BRANCH   1   9
ATOM      5  C   LIG    1       -3.579  -0.594  -0.645  0.00  0.00    +0.125 A 
ATOM      6  C   LIG    1       -4.475  -0.839   0.400  0.00  0.00    +0.091 A 
ATOM      7  C   LIG    1       -4.051  -1.500   1.547  0.00  0.00    +0.125 A 
ATOM      8  C   LIG    1       -2.718  -1.907   1.644  0.00  0.00    +0.069 A 
ATOM      9  C   LIG    1       -1.796  -1.654   0.617  0.00  0.00    +0.040 A 
ATOM     10  C   LIG    1       -2.246  -1.010  -0.537  0.00  0.00    +0.069 A 
BRANCH   5  12
ATOM     11  C   LIG    1       -3.275   0.370  -2.807  0.00  0.00    +0.277 C 
ATOM     12  O   LIG    1       -4.135   0.048  -1.720  0.00  0.00    -0.495 OA
ENDBRANCH   5  12
BRANCH   7  13
ATOM     13  O   LIG    1       -4.823  -1.808   2.633  0.00  0.00    -0.495 OA
ATOM     14  C   LIG    1       -6.193  -1.428   2.577  0.00  0.00    +0.277 C 
ENDBRANCH   7  13
ENDBRANCH   1   9
BRANCH   3  15
ATOM     15  C   LIG    1        0.880  -0.919  -0.915  0.00  0.00    +0.324 C 
BRANCH  15  16
ATOM     16  O   LIG    1        2.221  -0.618  -1.278  0.00  0.00    -0.483 OA
BRANCH  16  17
ATOM     17  C   LIG    1        2.882   0.339  -0.560  0.00  0.00    +0.125 A 
ATOM     18  C   LIG    1        4.087   0.766  -1.128  0.00  0.00    +0.091 A 
ATOM     19  C   LIG    1        4.875   1.740  -0.510  0.00  0.00    +0.124 A 
ATOM     20  C   LIG    1        4.452   2.291   0.698  0.00  0.00    +0.046 A 
ATOM     21  C   LIG    1        3.255   1.863   1.278  0.00  0.00    +0.007 A 
ATOM     22  C   LIG    1        2.472   0.888   0.653  0.00  0.00    +0.046 A 
BRANCH  19  23
ATOM     23  O   LIG    1        6.021   2.064  -1.184  0.00  0.00    -0.495 OA
ATOM     24  C   LIG    1        6.884   3.010  -0.567  0.00  0.00    +0.277 C 
ENDBRANCH  19  23
ENDBRANCH  16  17
ENDBRANCH  15  16
ENDBRANCH   3  15
TORSDOF 7