REMARK  Name = BDB032440
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.538   2.329  -1.765  0.00  0.00    +0.137 C 
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1        1.246  -0.240  -1.877  0.00  0.00    +0.215 A 
ATOM      3  N   LIG    1        1.795  -0.185  -0.645  0.00  0.00    -0.221 NA
ATOM      4  C   LIG    1        1.238   0.688   0.225  0.00  0.00    +0.115 A 
ATOM      5  C   LIG    1        0.175   1.521  -0.087  0.00  0.00    +0.025 A 
ATOM      6  C   LIG    1       -0.360   1.470  -1.377  0.00  0.00    -0.024 A 
ATOM      7  C   LIG    1        0.192   0.561  -2.288  0.00  0.00    +0.072 A 
BRANCH   2   8
ATOM      8  O   LIG    1        1.735  -1.122  -2.820  0.00  0.00    -0.476 OA
BRANCH   8   9
ATOM      9  C   LIG    1        2.725  -2.030  -2.326  0.00  0.00    +0.238 C 
BRANCH   9  10
ATOM     10  C   LIG    1        4.120  -1.423  -2.442  0.00  0.00    +0.115 C 
BRANCH  10  13
ATOM     11  C   LIG    1        5.224  -1.108   0.417  0.00  0.00    +0.150 C 
ATOM     12  N   LIG    1        5.602  -2.144  -0.514  0.00  0.00    -0.337 N 
ATOM     13  C   LIG    1        5.142  -2.301  -1.802  0.00  0.00    +0.113 A 
ATOM     14  N   LIG    1        5.716  -3.343  -2.373  0.00  0.00    -0.241 NA
ATOM     15  C   LIG    1        6.569  -3.862  -1.436  0.00  0.00    +0.130 A 
ATOM     16  C   LIG    1        6.509  -3.139  -0.270  0.00  0.00    +0.106 A 
ENDBRANCH  10  13
ENDBRANCH   9  10
ENDBRANCH   8   9
ENDBRANCH   2   8
ENDBRANCH   1   6
BRANCH   1  17
ATOM     17  N   LIG    1       -2.781   1.565  -1.690  0.00  0.00    -0.340 N 
ATOM     18  H   LIG    1       -2.713   0.710  -2.238  0.00  0.00    +0.146 HD
BRANCH  17  19
ATOM     19  C   LIG    1       -3.369   1.327  -0.441  0.00  0.00    +0.028 A 
ATOM     20  C   LIG    1       -3.460   2.302   0.559  0.00  0.00    +0.031 A 
ATOM     21  C   LIG    1       -4.091   2.047   1.794  0.00  0.00    -0.011 A 
ATOM     22  C   LIG    1       -4.678   0.788   2.039  0.00  0.00    +0.022 A 
ATOM     23  C   LIG    1       -5.296   0.588   3.299  0.00  0.00    +0.124 A 
ATOM     24  N   LIG    1       -5.340   1.534   4.254  0.00  0.00    -0.240 NA
ATOM     25  C   LIG    1       -4.775   2.725   3.984  0.00  0.00    +0.113 A 
ATOM     26  C   LIG    1       -4.620  -0.178   1.012  0.00  0.00    +0.014 A 
ATOM     27  C   LIG    1       -4.149   3.028   2.789  0.00  0.00    +0.028 A 
ATOM     28  C   LIG    1       -3.989   0.096  -0.206  0.00  0.00    +0.023 A 
BRANCH  23  29
ATOM     29  N   LIG    1       -5.903  -0.635   3.626  0.00  0.00    -0.343 N 
ATOM     30  H   LIG    1       -5.207  -1.372   3.587  0.00  0.00    +0.144 HD
ATOM     31  H   LIG    1       -6.633  -0.839   2.951  0.00  0.00    +0.144 HD
ENDBRANCH  23  29
ENDBRANCH  17  19
ENDBRANCH   1  17
TORSDOF 8