REMARK  Name = BDB034154
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.474   0.256   1.982  0.00  0.00    -0.294 NA
ATOM      2  C   LIG    1        0.614   0.040   2.948  0.00  0.00    +0.089 C 
ATOM      3  C   LIG    1        1.894  -0.446   2.244  0.00  0.00    +0.051 C 
ATOM      4  C   LIG    1        2.206   0.341   0.993  0.00  0.00    -0.040 C 
ATOM      5  C   LIG    1        1.280   1.167   0.470  0.00  0.00    -0.007 C 
ATOM      6  C   LIG    1       -0.105   1.324   1.036  0.00  0.00    +0.112 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.537   0.202   0.376  0.00  0.00    -0.004 A 
ATOM      8  C   LIG    1        4.713   0.280   1.123  0.00  0.00    +0.119 A 
ATOM      9  N   LIG    1        5.964   0.147   0.615  0.00  0.00    -0.250 NA
ATOM     10  C   LIG    1        6.047  -0.079  -0.727  0.00  0.00    +0.127 A 
ATOM     11  C   LIG    1        4.942  -0.179  -1.561  0.00  0.00    +0.034 A 
ATOM     12  C   LIG    1        3.675  -0.037  -0.996  0.00  0.00    +0.012 A 
BRANCH  10  13
ATOM     13  C   LIG    1        7.426  -0.233  -1.288  0.00  0.00    +0.285 C 
ATOM     14  N   LIG    1        8.421  -0.048  -0.349  0.00  0.00    -0.190 N 
ATOM     15  H   LIG    1        8.137  -0.140   0.624  0.00  0.00    +0.183 HD
ATOM     16  O   LIG    1        7.601  -0.514  -2.469  0.00  0.00    -0.266 OA
BRANCH  14  17
ATOM     17  O   LIG    1        9.666  -0.634  -0.686  0.00  0.00    -0.283 OA
ATOM     18  C   LIG    1       10.547   0.405  -1.101  0.00  0.00    +0.226 C 
ENDBRANCH  14  17
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  19
ATOM     19  C   LIG    1       -1.732   0.565   2.679  0.00  0.00    +0.121 C 
BRANCH  19  29
ATOM     20  C   LIG    1       -6.677  -0.469  -1.438  0.00  0.00    +0.019 A 
ATOM     21  C   LIG    1       -5.756  -1.652  -1.503  0.00  0.00    +0.252 A 
ATOM     22  O   LIG    1       -5.978  -2.606  -2.243  0.00  0.00    -0.268 OA
ATOM     23  N   LIG    1       -4.648  -1.626  -0.696  0.00  0.00    -0.321 N 
ATOM     24  H   LIG    1       -4.037  -2.430  -0.750  0.00  0.00    +0.169 HD
ATOM     25  C   LIG    1       -4.344  -0.556   0.153  0.00  0.00    +0.068 A 
ATOM     26  C   LIG    1       -5.187   0.551   0.206  0.00  0.00    +0.088 A 
ATOM     27  N   LIG    1       -4.969   1.625   0.995  0.00  0.00    -0.253 NA
ATOM     28  C   LIG    1       -3.853   1.586   1.762  0.00  0.00    +0.116 A 
ATOM     29  C   LIG    1       -2.941   0.531   1.776  0.00  0.00    -0.013 A 
ATOM     30  C   LIG    1       -3.208  -0.570   0.951  0.00  0.00    +0.034 A 
ATOM     31  C   LIG    1       -6.381   0.567  -0.631  0.00  0.00    +0.038 A 
BRANCH  20  33
ATOM     32  C   LIG    1       -9.000  -1.367  -1.771  0.00  0.00    +0.009 C 
ATOM     33  C   LIG    1       -7.888  -0.489  -2.328  0.00  0.00    +0.037 C 
ENDBRANCH  20  33
ENDBRANCH  19  29
ENDBRANCH   1  19
TORSDOF 6