REMARK  Name = BDB001662
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.109   1.486   0.023  0.00  0.00    +0.124 A 
ATOM      2  C   LIG    1        0.014   0.932   0.637  0.00  0.00    +0.059 A 
ATOM      3  C   LIG    1        0.219  -0.449   0.605  0.00  0.00    +0.047 A 
ATOM      4  C   LIG    1       -0.722  -1.291  -0.002  0.00  0.00    +0.059 A 
ATOM      5  C   LIG    1       -1.847  -0.742  -0.614  0.00  0.00    +0.124 A 
ATOM      6  C   LIG    1       -2.030   0.647  -0.607  0.00  0.00    +0.091 A 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1        1.387  -1.064   1.271  0.00  0.00    +0.266 C 
ATOM      8  N   LIG    1        2.717  -0.650   1.155  0.00  0.00    -0.236 N 
ATOM      9  C   LIG    1        3.327   0.228   0.272  0.00  0.00    +0.221 A 
ATOM     10  N   LIG    1        4.596   0.355   0.593  0.00  0.00    -0.113 NA
ATOM     11  N   LIG    1        4.868  -0.489   1.637  0.00  0.00    -0.136 NA
ATOM     12  C   LIG    1        3.749  -1.097   1.947  0.00  0.00    +0.233 A 
ATOM     13  O   LIG    1        1.172  -2.039   1.992  0.00  0.00    -0.267 OA
BRANCH   9  14
ATOM     14  N   LIG    1        2.724   0.828  -0.776  0.00  0.00    -0.327 N 
ATOM     15  H   LIG    1        3.371   1.311  -1.400  0.00  0.00    +0.145 HD
ATOM     16  H   LIG    1        2.013   0.337  -1.309  0.00  0.00    +0.145 HD
ENDBRANCH   9  14
ENDBRANCH   3   7
BRANCH   1  18
ATOM     17  C   LIG    1       -2.335   3.465  -0.469  0.00  0.00    +0.277 C 
ATOM     18  O   LIG    1       -1.190   2.848   0.108  0.00  0.00    -0.495 OA
ENDBRANCH   1  18
BRANCH   5  19
ATOM     19  O   LIG    1       -2.833  -1.442  -1.253  0.00  0.00    -0.495 OA
ATOM     20  C   LIG    1       -2.764  -2.862  -1.192  0.00  0.00    +0.277 C 
ENDBRANCH   5  19
TORSDOF 4