REMARK  Name = BDB035022
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.190   0.473   1.317  0.00  0.00    +0.036 A 
ATOM      2  N   LIG    1        0.398   0.965   0.300  0.00  0.00    -0.355 N 
ATOM      3  H   LIG    1        0.686   1.698  -0.340  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1       -0.794   0.285   0.256  0.00  0.00    +0.066 A 
ATOM      5  C   LIG    1       -0.764  -0.658   1.274  0.00  0.00    +0.091 A 
ATOM      6  N   LIG    1       -1.781  -1.511   1.523  0.00  0.00    -0.231 NA
ATOM      7  C   LIG    1       -2.851  -1.403   0.721  0.00  0.00    +0.120 A 
ATOM      8  C   LIG    1       -2.961  -0.476  -0.332  0.00  0.00    -0.009 A 
ATOM      9  C   LIG    1       -4.188  -0.402  -1.197  0.00  0.00    +0.047 C 
ATOM     10  C   LIG    1       -1.898   0.404  -0.583  0.00  0.00    +0.034 A 
ATOM     11  C   LIG    1        0.479  -0.537   1.938  0.00  0.00    +0.052 A 
ENDROOT
BRANCH   7  12
ATOM     12  N   LIG    1       -3.906  -2.293   0.989  0.00  0.00    -0.343 N 
ATOM     13  H   LIG    1       -4.743  -1.763   1.208  0.00  0.00    +0.144 HD
ATOM     14  H   LIG    1       -4.085  -2.859   0.167  0.00  0.00    +0.144 HD
ENDBRANCH   7  12
BRANCH   1  15
ATOM     15  C   LIG    1        2.536   1.038   1.577  0.00  0.00    +0.157 C 
BRANCH  15  18
ATOM     16  C   LIG    1        4.415   0.549  -1.670  0.00  0.00    +0.109 C 
ATOM     17  C   LIG    1        3.489   1.210  -0.685  0.00  0.00    +0.210 C 
ATOM     18  N   LIG    1        3.426   0.582   0.536  0.00  0.00    -0.310 N 
ATOM     19  H   LIG    1        3.780  -0.361   0.617  0.00  0.00    +0.149 HD
ATOM     20  O   LIG    1        2.828   2.204  -0.973  0.00  0.00    -0.276 OA
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 3