REMARK  Name = BDB048153
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.073  -1.139  -0.293  0.00  0.00    +0.095 A 
ATOM      2  C   LIG    1       -1.220  -0.365  -0.248  0.00  0.00    +0.135 A 
ATOM      3  N   LIG    1       -2.413  -0.930   0.032  0.00  0.00    -0.216 NA
ATOM      4  C   LIG    1       -2.471  -2.268   0.219  0.00  0.00    +0.136 A 
ATOM      5  N   LIG    1       -1.403  -3.084   0.131  0.00  0.00    -0.239 NA
ATOM      6  C   LIG    1       -0.221  -2.497  -0.131  0.00  0.00    +0.129 A 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -3.845  -2.887   0.474  0.00  0.00    +0.022 C 
ATOM      8  C   LIG    1       -3.727  -4.302   1.074  0.00  0.00    +0.019 C 
ATOM      9  C   LIG    1       -4.646  -2.017   1.460  0.00  0.00    +0.019 C 
ATOM     10  C   LIG    1       -4.597  -2.972  -0.864  0.00  0.00    +0.019 C 
ENDBRANCH   4   7
BRANCH   1  12
ATOM     11  N   LIG    1        2.187  -0.462   0.439  0.00  0.00    -0.293 N 
ATOM     12  C   LIG    1        1.244  -0.579  -0.589  0.00  0.00    +0.252 C 
ATOM     13  O   LIG    1        1.446  -0.257  -1.757  0.00  0.00    -0.270 OA
BRANCH  11  14
ATOM     14  C   LIG    1        3.510   0.121   0.132  0.00  0.00    +0.090 C 
ATOM     15  C   LIG    1        3.463   1.565  -0.420  0.00  0.00    +0.103 C 
ATOM     16  N   LIG    1        4.790   2.192  -0.532  0.00  0.00    -0.314 NA
ATOM     17  H   LIG    1        5.006   2.716   0.314  0.00  0.00    +0.122 HD
ATOM     18  C   LIG    1        5.869   1.243  -0.812  0.00  0.00    +0.081 C 
ATOM     19  C   LIG    1        5.402   0.004  -1.572  0.00  0.00    +0.017 C 
ATOM     20  C   LIG    1        4.357  -0.787  -0.780  0.00  0.00    +0.025 C 
ENDBRANCH  11  14
BRANCH  11  22
ATOM     21  C   LIG    1        1.458   0.659   2.534  0.00  0.00    +0.024 C 
ATOM     22  C   LIG    1        1.859  -0.644   1.860  0.00  0.00    +0.105 C 
ENDBRANCH  11  22
ENDBRANCH   1  12
BRANCH   2  23
ATOM     23  N   LIG    1       -1.144   1.031  -0.403  0.00  0.00    -0.321 N 
ATOM     24  H   LIG    1       -0.564   1.248  -1.218  0.00  0.00    +0.148 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -2.433   1.710  -0.510  0.00  0.00    +0.177 C 
BRANCH  25  26
ATOM     26  C   LIG    1       -2.287   3.175  -0.747  0.00  0.00    +0.122 A 
ATOM     27  O   LIG    1       -2.192   3.579  -2.048  0.00  0.00    -0.466 OA
ATOM     28  C   LIG    1       -2.051   4.929  -2.034  0.00  0.00    +0.195 A 
ATOM     29  C   LIG    1       -2.051   5.401  -0.743  0.00  0.00    +0.041 A 
ATOM     30  C   LIG    1       -2.200   4.268   0.092  0.00  0.00    +0.046 A 
ENDBRANCH  25  26
ENDBRANCH  23  25
ENDBRANCH   2  23
TORSDOF 7