REMARK  Name = BDB059654
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.418   0.460  -0.458  0.00  0.00    +0.041 A 
ATOM      2  C   LIG    1       -2.280  -0.483  -1.284  0.00  0.00    +0.278 A 
ATOM      3  O   LIG    1       -2.779  -0.204  -2.367  0.00  0.00    -0.265 OA
ATOM      4  N   LIG    1       -2.489  -1.746  -0.710  0.00  0.00    -0.179 N 
ATOM      5  C   LIG    1       -1.985  -2.147   0.507  0.00  0.00    +0.155 A 
ATOM      6  C   LIG    1       -2.427  -3.430   0.714  0.00  0.00    +0.114 A 
ATOM      7  C   LIG    1       -3.189  -3.735  -0.427  0.00  0.00    +0.156 A 
ATOM      8  N   LIG    1       -1.224  -1.275   1.200  0.00  0.00    -0.342 N 
ATOM      9  H   LIG    1       -0.861  -1.509   2.125  0.00  0.00    +0.167 HD
ATOM     10  N   LIG    1       -3.236  -2.724  -1.300  0.00  0.00    -0.169 NA
ATOM     11  C   LIG    1       -0.920   0.002   0.725  0.00  0.00    +0.027 A 
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1        0.182   2.198  -1.467  0.00  0.00    +0.012 C 
ATOM     13  C   LIG    1       -1.258   1.838  -1.097  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1       -1.939   2.947  -0.289  0.00  0.00    +0.012 C 
ENDBRANCH   1  13
BRANCH   6  15
ATOM     15  C   LIG    1       -2.164  -4.260   1.836  0.00  0.00    +0.104 C 
ATOM     16  N   LIG    1       -1.939  -4.924   2.761  0.00  0.00    -0.191 NA
ENDBRANCH   6  15
BRANCH  11  17
ATOM     17  C   LIG    1       -0.032   0.814   1.664  0.00  0.00    +0.058 C 
BRANCH  17  18
ATOM     18  C   LIG    1        1.341   0.184   1.969  0.00  0.00    +0.041 C 
BRANCH  18  19
ATOM     19  C   LIG    1        2.283   0.157   0.791  0.00  0.00    -0.047 A 
ATOM     20  C   LIG    1        2.277  -0.923  -0.102  0.00  0.00    +0.003 A 
ATOM     21  C   LIG    1        3.138  -0.937  -1.201  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        4.015   0.124  -1.415  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        4.032   1.201  -0.530  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1        3.171   1.218   0.568  0.00  0.00    +0.003 A 
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH  11  17
TORSDOF 5