REMARK  Name = BDB032381
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.595  -0.830   0.132  0.00  0.00    +0.139 C 
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1        1.562   0.390   0.427  0.00  0.00    -0.022 A 
ATOM      3  C   LIG    1        1.177  -0.924   0.725  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1       -0.159  -1.320   0.621  0.00  0.00    +0.005 A 
ATOM      5  C   LIG    1       -1.143  -0.407   0.219  0.00  0.00    -0.030 A 
ATOM      6  C   LIG    1       -0.763   0.915  -0.054  0.00  0.00    +0.005 A 
ATOM      7  C   LIG    1        0.573   1.309   0.049  0.00  0.00    +0.006 A 
BRANCH   2   8
ATOM      8  C   LIG    1        2.995   0.841   0.574  0.00  0.00    +0.195 C 
BRANCH   8   9
ATOM      9  O   LIG    1        3.886  -0.217   0.219  0.00  0.00    -0.372 OA
BRANCH   9  14
ATOM     10  C   LIG    1        9.428  -0.006   0.918  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1        7.997   0.110   0.645  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1        7.245   0.358   1.884  0.00  0.00    +0.086 C 
ATOM     13  C   LIG    1        5.755   0.018   1.773  0.00  0.00    +0.047 C 
ATOM     14  C   LIG    1        5.266   0.144   0.332  0.00  0.00    +0.121 C 
ATOM     15  C   LIG    1        6.068  -0.797  -0.577  0.00  0.00    +0.047 C 
ATOM     16  C   LIG    1        7.488  -1.060  -0.069  0.00  0.00    +0.086 C 
ENDBRANCH   9  14
ENDBRANCH   8   9
ENDBRANCH   2   8
ENDBRANCH   1   5
BRANCH   1  17
ATOM     17  N   LIG    1       -3.209  -0.420  -1.150  0.00  0.00    -0.329 N 
ATOM     18  C   LIG    1       -2.701  -1.133  -2.325  0.00  0.00    +0.129 C 
BRANCH  17  19
ATOM     19  C   LIG    1       -4.597  -0.216  -1.067  0.00  0.00    +0.030 A 
ATOM     20  C   LIG    1       -5.096   0.800  -0.233  0.00  0.00    +0.031 A 
ATOM     21  C   LIG    1       -6.473   1.067  -0.104  0.00  0.00    -0.011 A 
ATOM     22  C   LIG    1       -7.406   0.306  -0.834  0.00  0.00    +0.022 A 
ATOM     23  C   LIG    1       -8.778   0.617  -0.664  0.00  0.00    +0.124 A 
ATOM     24  N   LIG    1       -9.216   1.594   0.151  0.00  0.00    -0.240 NA
ATOM     25  C   LIG    1       -8.294   2.302   0.830  0.00  0.00    +0.113 A 
ATOM     26  C   LIG    1       -6.908  -0.707  -1.683  0.00  0.00    +0.014 A 
ATOM     27  C   LIG    1       -6.933   2.082   0.738  0.00  0.00    +0.028 A 
ATOM     28  C   LIG    1       -5.533  -0.955  -1.797  0.00  0.00    +0.024 A 
BRANCH  23  29
ATOM     29  N   LIG    1       -9.776  -0.091  -1.355  0.00  0.00    -0.343 N 
ATOM     30  H   LIG    1       -9.623   0.014  -2.353  0.00  0.00    +0.144 HD
ATOM     31  H   LIG    1       -9.712  -1.075  -1.117  0.00  0.00    +0.144 HD
ENDBRANCH  23  29
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 7