REMARK  Name = BDB018728
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -2.823   0.553   1.022  0.00  0.00    -0.268 N 
ATOM      2  C   LIG    1       -1.463   0.842   0.466  0.00  0.00    +0.134 C 
ATOM      3  C   LIG    1       -1.099  -0.349  -0.433  0.00  0.00    +0.080 C 
ATOM      4  C   LIG    1       -0.313  -1.384   0.354  0.00  0.00    +0.227 C 
ATOM      5  O   LIG    1       -0.847  -2.421   0.766  0.00  0.00    -0.275 OA
ATOM      6  N   LIG    1        0.994  -1.212   0.685  0.00  0.00    -0.282 N 
ATOM      7  H   LIG    1        1.310  -1.958   1.295  0.00  0.00    +0.155 HD
ATOM      8  C   LIG    1        1.978  -0.300   0.255  0.00  0.00    +0.074 A 
ATOM      9  C   LIG    1        1.838   0.707  -0.710  0.00  0.00    +0.140 A 
ATOM     10  N   LIG    1        2.869   1.503  -1.073  0.00  0.00    -0.239 NA
ATOM     11  C   LIG    1        4.068   1.318  -0.483  0.00  0.00    +0.113 A 
ATOM     12  C   LIG    1        4.304   0.354   0.473  0.00  0.00    +0.022 A 
ATOM     13  N   LIG    1        0.675   1.044  -1.364  0.00  0.00    -0.327 N 
ATOM     14  H   LIG    1        0.933   1.677  -2.120  0.00  0.00    +0.148 HD
ATOM     15  C   LIG    1        3.243  -0.464   0.840  0.00  0.00    +0.028 A 
ATOM     16  C   LIG    1       -0.303   0.030  -1.675  0.00  0.00    +0.120 C 
ATOM     17  C   LIG    1       -2.484  -0.896  -0.824  0.00  0.00    +0.039 C 
ATOM     18  C   LIG    1       -3.326  -0.709   0.430  0.00  0.00    +0.117 C 
ENDROOT
BRANCH   1  20
ATOM     19  N   LIG    1       -3.721   1.576   3.114  0.00  0.00    -0.174 NA
ATOM     20  C   LIG    1       -3.306   1.102   2.143  0.00  0.00    +0.169 C 
ENDBRANCH   1  20
TORSDOF 1