REMARK  Name = BDB035023
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.010  -0.785  -0.786  0.00  0.00    +0.036 A 
ATOM      2  N   LIG    1        0.261   0.368  -0.888  0.00  0.00    -0.355 N 
ATOM      3  H   LIG    1        0.649   1.276  -1.123  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1       -1.052   0.110  -0.583  0.00  0.00    +0.066 A 
ATOM      5  C   LIG    1       -1.143  -1.244  -0.288  0.00  0.00    +0.091 A 
ATOM      6  N   LIG    1       -2.300  -1.849   0.059  0.00  0.00    -0.231 NA
ATOM      7  C   LIG    1       -3.386  -1.063   0.106  0.00  0.00    +0.120 A 
ATOM      8  C   LIG    1       -3.379   0.315  -0.178  0.00  0.00    -0.009 A 
ATOM      9  C   LIG    1       -4.630   1.144  -0.110  0.00  0.00    +0.047 C 
ATOM     10  C   LIG    1       -2.172   0.933  -0.536  0.00  0.00    +0.034 A 
ATOM     11  C   LIG    1        0.150  -1.803  -0.419  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   7  12
ATOM     12  N   LIG    1       -4.586  -1.702   0.465  0.00  0.00    -0.343 N 
ATOM     13  H   LIG    1       -5.258  -1.599  -0.287  0.00  0.00    +0.144 HD
ATOM     14  H   LIG    1       -4.962  -1.266   1.300  0.00  0.00    +0.144 HD
ENDBRANCH   7  12
BRANCH   1  15
ATOM     15  C   LIG    1        2.472  -0.774  -1.062  0.00  0.00    +0.160 C 
BRANCH  15  18
ATOM     16  C   LIG    1        3.916   1.906   1.236  0.00  0.00    +0.109 C 
ATOM     17  C   LIG    1        3.247   1.255   0.052  0.00  0.00    +0.213 C 
ATOM     18  N   LIG    1        3.173  -0.132   0.044  0.00  0.00    -0.299 N 
ATOM     19  C   LIG    1        3.448  -0.961   1.210  0.00  0.00    +0.132 C 
ATOM     20  O   LIG    1        2.781   1.950  -0.855  0.00  0.00    -0.276 OA
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 3