REMARK  Name = BDB059651
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.180  -0.967  -0.045  0.00  0.00    +0.081 A 
ATOM      2  C   LIG    1       -2.522  -0.318   0.180  0.00  0.00    +0.282 A 
ATOM      3  O   LIG    1       -3.525  -0.909   0.558  0.00  0.00    -0.265 OA
ATOM      4  N   LIG    1       -2.556   1.064  -0.079  0.00  0.00    -0.178 N 
ATOM      5  C   LIG    1       -1.474   1.811  -0.504  0.00  0.00    +0.158 A 
ATOM      6  C   LIG    1       -1.919   3.101  -0.648  0.00  0.00    +0.114 A 
ATOM      7  C   LIG    1       -3.277   3.053  -0.287  0.00  0.00    +0.156 A 
ATOM      8  N   LIG    1       -0.296   1.175  -0.680  0.00  0.00    -0.309 N 
ATOM      9  H   LIG    1        0.545   1.645  -1.017  0.00  0.00    +0.170 HD
ATOM     10  N   LIG    1       -3.677   1.826   0.062  0.00  0.00    -0.169 NA
ATOM     11  C   LIG    1       -0.151  -0.182  -0.441  0.00  0.00    +0.209 A 
ENDROOT
BRANCH   1  13
ATOM     12  C   LIG    1       -1.304  -2.837   1.660  0.00  0.00    +0.012 C 
ATOM     13  C   LIG    1       -1.058  -2.461   0.196  0.00  0.00    +0.023 C 
ATOM     14  C   LIG    1       -1.944  -3.281  -0.746  0.00  0.00    +0.012 C 
ENDBRANCH   1  13
BRANCH   6  15
ATOM     15  C   LIG    1       -1.168   4.232  -1.068  0.00  0.00    +0.104 C 
ATOM     16  N   LIG    1       -0.548   5.150  -1.411  0.00  0.00    -0.191 NA
ENDBRANCH   6  15
BRANCH  11  17
ATOM     17  O   LIG    1        1.093  -0.761  -0.685  0.00  0.00    -0.439 OA
BRANCH  17  18
ATOM     18  C   LIG    1        2.222  -0.101  -0.257  0.00  0.00    +0.130 A 
ATOM     19  C   LIG    1        2.335   0.444   1.024  0.00  0.00    +0.046 A 
ATOM     20  C   LIG    1        3.515   1.086   1.400  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1        4.581   1.170   0.503  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        4.473   0.605  -0.768  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        3.294  -0.038  -1.146  0.00  0.00    +0.046 A 
ENDBRANCH  17  18
ENDBRANCH  11  17
TORSDOF 4