REMARK  Name = BDB033675
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.148  -1.164  -0.696  0.00  0.00    +0.000 A 
ATOM      2  N   LIG    1        0.879  -1.960  -0.334  0.00  0.00    +0.000 N 
ATOM      3  N   LIG    1        0.470  -3.220  -0.343  0.00  0.00    +0.000 NA
ATOM      4  C   LIG    1       -0.832  -3.233  -0.690  0.00  0.00    +0.000 A 
ATOM      5  C   LIG    1       -1.267  -1.942  -0.922  0.00  0.00    +0.000 A 
ENDROOT
BRANCH   2   6
ATOM      6  C   LIG    1        2.230  -1.582  -0.023  0.00  0.00    +0.000 A 
ATOM      7  N   LIG    1        3.236  -2.469  -0.255  0.00  0.00    +0.000 NA
ATOM      8  C   LIG    1        4.532  -2.182   0.030  0.00  0.00    +0.000 A 
ATOM      9  C   LIG    1        4.872  -0.948   0.586  0.00  0.00    +0.000 A 
ATOM     10  C   LIG    1        3.866  -0.006   0.853  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1        2.532  -0.338   0.557  0.00  0.00    +0.000 A 
BRANCH  10  12
ATOM     12  C   LIG    1        4.186   1.307   1.466  0.00  0.00    +0.000 C 
ATOM     13  O   LIG    1        3.286   1.952   2.069  0.00  0.00    +0.000 OA
BRANCH  12  14
ATOM     14  O   LIG    1        5.461   1.865   1.384  0.00  0.00    +0.000 OA
ATOM     15  H   LIG    1        6.202   1.454   0.832  0.00  0.00    +0.000 HD
ENDBRANCH  12  14
ENDBRANCH  10  12
ENDBRANCH   2   6
BRANCH   1  16
ATOM     16  O   LIG    1       -0.055   0.226  -0.852  0.00  0.00    +0.000 OA
BRANCH  16  17
ATOM     17  C   LIG    1       -1.161   1.057  -1.203  0.00  0.00    +0.000 C 
BRANCH  17  19
ATOM     18  C   LIG    1       -3.561   1.387  -0.330  0.00  0.00    +0.000 A 
ATOM     19  C   LIG    1       -2.183   1.141  -0.083  0.00  0.00    +0.000 A 
ATOM     20  C   LIG    1       -1.742   1.039   1.252  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1       -2.647   1.102   2.312  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -4.005   1.292   2.062  0.00  0.00    +0.000 A 
ATOM     23 CL   LIG    1       -5.139   1.369   3.398  0.00  0.00    +0.000 Cl
ATOM     24  C   LIG    1       -4.459   1.440   0.750  0.00  0.00    +0.000 A 
BRANCH  18  25
ATOM     25  B   LIG    1       -4.152   1.636  -1.773  0.00  0.00    +0.000 B 
ATOM     26  H   LIG    1       -5.312   1.817  -1.913  0.00  0.00    +0.000 HD
ATOM     27  H   LIG    1       -3.464   1.775  -2.721  0.00  0.00    +0.000 HD
ENDBRANCH  18  25
ENDBRANCH  17  19
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 7