REMARK  Name = BDB010305
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.448  -1.304  -0.415  0.00  0.00    -0.303 NA
ATOM      2  H   LIG    1       -1.335  -1.672  -0.751  0.00  0.00    +0.123 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        0.581  -2.346  -0.591  0.00  0.00    +0.178 C 
BRANCH   3   5
ATOM      4  N   LIG    1        2.723  -1.052  -0.894  0.00  0.00    -0.299 N 
ATOM      5  C   LIG    1        1.964  -1.902  -0.096  0.00  0.00    +0.229 C 
ATOM      6  O   LIG    1        2.372  -2.307   0.998  0.00  0.00    -0.274 OA
BRANCH   4   8
ATOM      7  C   LIG    1        2.769  -1.267  -3.352  0.00  0.00    +0.024 C 
ATOM      8  C   LIG    1        2.271  -0.468  -2.158  0.00  0.00    +0.104 C 
ENDBRANCH   4   8
BRANCH   4   9
ATOM      9  C   LIG    1        4.028  -0.617  -0.386  0.00  0.00    +0.123 C 
BRANCH   9  10
ATOM     10  C   LIG    1        3.912   0.621   0.531  0.00  0.00    +0.102 C 
BRANCH  10  11
ATOM     11  N   LIG    1        5.158   1.153   1.113  0.00  0.00    -0.307 NA
ATOM     12  C   LIG    1        6.119   1.583   0.104  0.00  0.00    +0.104 C 
ATOM     13  C   LIG    1        5.766   0.219   2.058  0.00  0.00    +0.104 C 
ENDBRANCH  10  11
ENDBRANCH   9  10
ENDBRANCH   4   9
ENDBRANCH   3   5
ENDBRANCH   1   3
BRANCH   1  14
ATOM     14  C   LIG    1       -0.603  -0.927   1.002  0.00  0.00    +0.137 C 
BRANCH  14  15
ATOM     15  C   LIG    1       -1.754   0.043   1.211  0.00  0.00    +0.056 A 
ATOM     16  N   LIG    1       -1.449   1.349   1.424  0.00  0.00    -0.259 NA
ATOM     17  C   LIG    1       -2.467   2.214   1.627  0.00  0.00    +0.112 A 
ATOM     18  C   LIG    1       -3.798   1.850   1.602  0.00  0.00    +0.033 A 
ATOM     19  C   LIG    1       -4.093   0.515   1.341  0.00  0.00    +0.040 A 
ATOM     20  C   LIG    1       -3.067  -0.412   1.167  0.00  0.00    +0.037 A 
BRANCH  19  21
ATOM     21  C   LIG    1       -5.492   0.036   1.322  0.00  0.00    +0.246 C 
ATOM     22  N   LIG    1       -6.435   0.717   0.553  0.00  0.00    -0.304 N 
ATOM     23  C   LIG    1       -6.112   1.563  -0.589  0.00  0.00    +0.132 C 
ATOM     24  C   LIG    1       -7.828   0.327   0.682  0.00  0.00    +0.132 C 
ATOM     25  O   LIG    1       -5.761  -0.946   2.011  0.00  0.00    -0.270 OA
ENDBRANCH  19  21
ENDBRANCH  14  15
ENDBRANCH   1  14
TORSDOF 9