REMARK  Name = BDB007667
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.483   2.833   0.755  0.00  0.00    -0.269 OA
ATOM      2  C   LIG    1        0.407   1.657   1.114  0.00  0.00    +0.263 C 
ATOM      3  N   LIG    1       -0.700   1.263   1.830  0.00  0.00    -0.308 N 
ATOM      4  H   LIG    1       -1.363   2.021   1.949  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1        1.512   0.710   0.769  0.00  0.00    +0.130 A 
ATOM      6  N   LIG    1        1.228  -0.609   0.712  0.00  0.00    -0.231 NA
ATOM      7  C   LIG    1        2.262  -1.388   0.377  0.00  0.00    +0.224 A 
ATOM      8  N   LIG    1        3.504  -0.975   0.091  0.00  0.00    -0.221 NA
ATOM      9  C   LIG    1        3.740   0.345   0.125  0.00  0.00    +0.123 A 
ATOM     10  C   LIG    1        2.753   1.239   0.476  0.00  0.00    +0.076 A 
BRANCH   9  11
ATOM     11  N   LIG    1        5.025   0.846  -0.129  0.00  0.00    -0.326 N 
ATOM     12  H   LIG    1        4.972   1.650  -0.750  0.00  0.00    +0.148 HD
BRANCH  11  13
ATOM     13  C   LIG    1        6.055  -0.120  -0.539  0.00  0.00    +0.076 C 
ATOM     14  C   LIG    1        7.440   0.502  -0.293  0.00  0.00    +0.050 C 
ATOM     15  C   LIG    1        7.987   1.125  -1.567  0.00  0.00    +0.161 C 
ATOM     16  O   LIG    1        8.144   0.177  -2.622  0.00  0.00    -0.380 OA
ATOM     17  C   LIG    1        7.213  -0.904  -2.616  0.00  0.00    +0.161 C 
ATOM     18  C   LIG    1        5.874  -0.521  -2.010  0.00  0.00    +0.050 C 
ENDBRANCH  11  13
ENDBRANCH   9  11
ENDBRANCH   2   5
BRANCH   3  19
ATOM     19  C   LIG    1       -0.953   0.036   2.577  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.946  -0.922   1.880  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.461  -1.310   0.588  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1       -0.513  -1.072   0.546  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -3.352  -0.281   1.751  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -4.464  -1.249   1.611  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -5.773  -0.564   1.623  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -6.149   0.129   0.330  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -5.568  -0.257  -0.892  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -5.958   0.377  -2.079  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -6.936   1.371  -2.058  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -7.527   1.742  -0.853  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -4.482  -1.305  -0.919  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -7.139   1.122   0.335  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -4.383  -2.086   0.400  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 8