REMARK  Name = BDB015012
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.163  -0.675  -0.621  0.00  0.00    +0.261 C 
ENDROOT
BRANCH   1   2
ATOM      2  O   LIG    1        1.029  -0.204  -1.268  0.00  0.00    -0.489 OA
BRANCH   2   5
ATOM      3  C   LIG    1        4.215   1.329  -0.404  0.00  0.00    -0.011 A 
ATOM      4  C   LIG    1        3.186   0.657  -1.081  0.00  0.00    +0.054 A 
ATOM      5  C   LIG    1        1.940   0.445  -0.480  0.00  0.00    +0.121 A 
ATOM      6  C   LIG    1        1.715   0.910   0.814  0.00  0.00    +0.045 A 
ATOM      7  C   LIG    1        2.727   1.587   1.497  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1        3.968   1.794   0.893  0.00  0.00    +0.009 A 
BRANCH   3  13
ATOM      9  C   LIG    1        8.674   3.139  -1.647  0.00  0.00    +0.172 C 
ATOM     10  N   LIG    1        7.472   2.342  -1.590  0.00  0.00    -0.274 N 
ATOM     11  N   LIG    1        7.357   1.257  -2.374  0.00  0.00    -0.179 NA
ATOM     12  C   LIG    1        6.162   0.759  -2.044  0.00  0.00    +0.142 A 
ATOM     13  C   LIG    1        5.507   1.517  -1.043  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1        6.394   2.542  -0.776  0.00  0.00    +0.116 A 
ENDBRANCH   3  13
ENDBRANCH   2   5
ENDBRANCH   1   2
BRANCH   1  15
ATOM     15  C   LIG    1       -0.969  -1.454  -1.666  0.00  0.00    +0.166 C 
BRANCH  15  16
ATOM     16  O   LIG    1       -1.400  -0.576  -2.717  0.00  0.00    -0.387 OA
ATOM     17  H   LIG    1       -0.622  -0.033  -2.944  0.00  0.00    +0.210 HD
ENDBRANCH  15  16
BRANCH  15  18
ATOM     18  C   LIG    1       -2.171  -2.215  -1.066  0.00  0.00    +0.119 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -2.961  -1.494  -0.044  0.00  0.00    -0.295 NA
ATOM     20  C   LIG    1       -3.892  -2.439   0.612  0.00  0.00    +0.120 C 
ATOM     21  C   LIG    1       -4.863  -1.782   1.569  0.00  0.00    -0.030 A 
ATOM     22  C   LIG    1       -5.132  -0.406   1.492  0.00  0.00    -0.042 A 
ATOM     23  C   LIG    1       -6.056   0.175   2.370  0.00  0.00    +0.004 A 
ATOM     24  C   LIG    1       -6.734  -0.613   3.299  0.00  0.00    +0.000 A 
ATOM     25  C   LIG    1       -6.488  -1.982   3.364  0.00  0.00    +0.000 A 
ATOM     26  C   LIG    1       -4.386   0.446   0.499  0.00  0.00    +0.051 C 
ATOM     27  C   LIG    1       -5.557  -2.565   2.505  0.00  0.00    +0.005 A 
ATOM     28  C   LIG    1       -3.735  -0.380  -0.621  0.00  0.00    +0.089 C 
ENDBRANCH  18  19
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 7