REMARK  Name = BDB000293
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.849  -0.205  -0.801  0.00  0.00    -0.011 A 
ATOM      2  C   LIG    1        0.608   0.111  -0.217  0.00  0.00    +0.036 A 
ATOM      3  C   LIG    1       -0.427  -0.835  -0.131  0.00  0.00    +0.079 A 
ATOM      4  N   LIG    1       -1.668  -0.552   0.503  0.00  0.00    -0.265 N 
ATOM      5  C   LIG    1       -2.711  -1.471   0.448  0.00  0.00    +0.264 C 
ATOM      6  C   LIG    1       -2.480  -2.684  -0.490  0.00  0.00    +0.186 C 
ATOM      7  O   LIG    1       -1.129  -3.113  -0.647  0.00  0.00    -0.475 OA
ATOM      8  O   LIG    1       -3.789  -1.287   1.020  0.00  0.00    -0.271 OA
ATOM      9  C   LIG    1       -0.205  -2.107  -0.667  0.00  0.00    +0.143 A 
ATOM     10  C   LIG    1        1.025  -2.441  -1.237  0.00  0.00    +0.048 A 
ATOM     11  C   LIG    1        2.046  -1.496  -1.307  0.00  0.00    +0.012 A 
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1        3.872   0.985   0.111  0.00  0.00    +0.056 A 
ATOM     13  C   LIG    1        2.915   0.802  -0.885  0.00  0.00    +0.043 A 
ATOM     14  C   LIG    1        3.049   1.650  -1.989  0.00  0.00    +0.129 A 
ATOM     15  N   LIG    1        4.011   2.578  -2.088  0.00  0.00    -0.199 NA
ATOM     16  C   LIG    1        4.861   2.685  -1.072  0.00  0.00    +0.214 A 
ATOM     17  N   LIG    1        4.848   1.918   0.018  0.00  0.00    -0.219 NA
BRANCH  14  18
ATOM     18  N   LIG    1        2.148   1.585  -3.071  0.00  0.00    -0.343 N 
ATOM     19  H   LIG    1        2.133   0.641  -3.445  0.00  0.00    +0.144 HD
ATOM     20  H   LIG    1        1.212   1.792  -2.734  0.00  0.00    +0.144 HD
ENDBRANCH  14  18
BRANCH  16  21
ATOM     21  N   LIG    1        5.863   3.628  -1.174  0.00  0.00    -0.327 N 
ATOM     22  H   LIG    1        6.658   3.341  -0.622  0.00  0.00    +0.145 HD
ATOM     23  H   LIG    1        6.020   3.841  -2.149  0.00  0.00    +0.145 HD
ENDBRANCH  16  21
BRANCH  12  25
ATOM     24  C   LIG    1        3.143   0.894   2.511  0.00  0.00    +0.010 C 
ATOM     25  C   LIG    1        3.887   0.183   1.390  0.00  0.00    +0.053 C 
ENDBRANCH  12  25
ENDBRANCH   1  13
BRANCH   6  26
ATOM     26  C   LIG    1       -3.262  -3.903   0.062  0.00  0.00    +0.054 C 
ATOM     27  C   LIG    1       -2.755  -4.387   1.420  0.00  0.00    +0.008 C 
ENDBRANCH   6  26
BRANCH   6  28
ATOM     28  C   LIG    1       -3.045  -2.270  -1.880  0.00  0.00    +0.054 C 
ATOM     29  C   LIG    1       -2.872  -3.306  -2.986  0.00  0.00    +0.008 C 
ENDBRANCH   6  28
BRANCH   4  30
ATOM     30  C   LIG    1       -1.874   0.691   1.247  0.00  0.00    +0.116 C 
BRANCH  30  31
ATOM     31  C   LIG    1       -2.434   1.799   0.352  0.00  0.00    +0.047 C 
BRANCH  31  32
ATOM     32  C   LIG    1       -2.488   3.132   1.085  0.00  0.00    +0.161 C 
BRANCH  32  33
ATOM     33  O   LIG    1       -1.154   3.529   1.401  0.00  0.00    -0.383 OA
ATOM     34  C   LIG    1       -1.123   4.788   2.061  0.00  0.00    +0.193 C 
ENDBRANCH  32  33
ENDBRANCH  31  32
ENDBRANCH  30  31
ENDBRANCH   4  30
TORSDOF 10