REMARK  Name = BDB018261
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.029   0.325  -0.508  0.00  0.00    +0.024 A 
ATOM      2  C   LIG    1        0.222  -0.251  -0.448  0.00  0.00    +0.117 A 
ATOM      3  N   LIG    1        0.882   0.137  -1.585  0.00  0.00    -0.264 N 
ATOM      4  N   LIG    1        0.132   0.924  -2.387  0.00  0.00    -0.178 NA
ATOM      5  C   LIG    1       -1.027   1.033  -1.729  0.00  0.00    +0.143 A 
ENDROOT
BRANCH   1   7
ATOM      6  C   LIG    1       -3.486   0.058   0.117  0.00  0.00    +0.135 A 
ATOM      7  C   LIG    1       -2.068   0.217   0.480  0.00  0.00    +0.043 A 
ATOM      8  C   LIG    1       -1.766   0.269   1.794  0.00  0.00    +0.101 A 
ATOM      9  N   LIG    1       -2.723   0.186   2.792  0.00  0.00    -0.317 N 
ATOM     10  C   LIG    1       -2.288   0.268   4.177  0.00  0.00    +0.152 C 
ATOM     11  C   LIG    1       -4.074   0.053   2.509  0.00  0.00    +0.255 A 
ATOM     12  O   LIG    1       -4.969  -0.013   3.346  0.00  0.00    -0.268 OA
ATOM     13  C   LIG    1       -4.429  -0.017   1.071  0.00  0.00    +0.116 A 
BRANCH   6  14
ATOM     14  O   LIG    1       -3.720  -0.022  -1.241  0.00  0.00    -0.491 OA
BRANCH  14  16
ATOM     15  C   LIG    1       -5.036  -0.268  -3.210  0.00  0.00    +0.048 C 
ATOM     16  C   LIG    1       -5.060  -0.209  -1.694  0.00  0.00    +0.226 C 
ENDBRANCH  14  16
ENDBRANCH   6  14
ENDBRANCH   1   7
BRANCH   3  17
ATOM     17  C   LIG    1        2.241  -0.235  -2.000  0.00  0.00    +0.134 C 
ATOM     18  C   LIG    1        2.263  -1.682  -2.502  0.00  0.00    +0.038 C 
BRANCH  17  19
ATOM     19  C   LIG    1        3.252   0.111  -0.913  0.00  0.00    -0.023 A 
ATOM     20  C   LIG    1        3.566   1.463  -0.687  0.00  0.00    +0.006 A 
ATOM     21  C   LIG    1        4.478   1.835   0.304  0.00  0.00    +0.004 A 
ATOM     22  C   LIG    1        5.106   0.864   1.089  0.00  0.00    -0.050 A 
ATOM     23  C   LIG    1        6.060   1.264   2.175  0.00  0.00    +0.044 C 
ATOM     24  C   LIG    1        4.786  -0.481   0.884  0.00  0.00    +0.004 A 
ATOM     25  C   LIG    1        3.873  -0.855  -0.107  0.00  0.00    +0.006 A 
ENDBRANCH  17  19
ENDBRANCH   3  17
TORSDOF 5