REMARK  Name = BDB026950
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.369   0.982   0.299  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        4.322  -0.421   0.302  0.00  0.00    +0.039 A 
ATOM      3  C   LIG    1        3.083  -1.032   0.056  0.00  0.00    +0.048 A 
ATOM      4  C   LIG    1        1.913  -0.309  -0.187  0.00  0.00    +0.010 A 
ATOM      5  C   LIG    1        0.848  -1.254  -0.397  0.00  0.00    +0.044 A 
ATOM      6  C   LIG    1        1.417  -2.511  -0.267  0.00  0.00    +0.095 A 
ATOM      7  C   LIG    1        1.988   1.101  -0.171  0.00  0.00    +0.011 A 
ATOM      8  N   LIG    1        2.752  -2.364   0.008  0.00  0.00    -0.360 N 
ATOM      9  H   LIG    1        3.404  -3.123   0.154  0.00  0.00    +0.165 HD
ATOM     10  C   LIG    1        3.212   1.733   0.079  0.00  0.00    +0.014 A 
ENDROOT
BRANCH   1  13
ATOM     11  N   LIG    1        6.796   1.077   0.128  0.00  0.00    -0.312 N 
ATOM     12  H   LIG    1        6.689   0.356  -0.573  0.00  0.00    +0.149 HD
ATOM     13  C   LIG    1        5.644   1.709   0.556  0.00  0.00    +0.244 C 
ATOM     14  O   LIG    1        5.632   2.814   1.085  0.00  0.00    -0.270 OA
BRANCH  11  16
ATOM     15  C   LIG    1        9.228   0.813   0.009  0.00  0.00    +0.024 C 
ATOM     16  C   LIG    1        8.066   1.772   0.179  0.00  0.00    +0.101 C 
ENDBRANCH  11  16
ENDBRANCH   1  13
BRANCH   5  17
ATOM     17  C   LIG    1       -0.565  -0.944  -0.691  0.00  0.00    +0.182 C 
ATOM     18  O   LIG    1       -0.910   0.226  -0.859  0.00  0.00    -0.290 OA
BRANCH  17  19
ATOM     19  C   LIG    1       -1.582  -2.119  -0.754  0.00  0.00    +0.122 C 
ATOM     20  C   LIG    1       -1.964  -2.587   0.650  0.00  0.00    +0.032 C 
BRANCH  19  21
ATOM     21  N   LIG    1       -2.725  -1.834  -1.661  0.00  0.00    -0.307 NA
ATOM     22  H   LIG    1       -2.993  -2.707  -2.115  0.00  0.00    +0.123 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -3.940  -1.256  -1.071  0.00  0.00    +0.086 C 
BRANCH  23  24
ATOM     24  C   LIG    1       -3.833   0.185  -0.556  0.00  0.00    +0.050 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -5.178   0.707  -0.098  0.00  0.00    -0.046 A 
ATOM     26  C   LIG    1       -6.024   1.370  -0.997  0.00  0.00    +0.005 A 
ATOM     27  C   LIG    1       -7.274   1.836  -0.580  0.00  0.00    +0.019 A 
ATOM     28  C   LIG    1       -7.690   1.640   0.740  0.00  0.00    +0.052 A 
ATOM     29  C   LIG    1       -6.852   0.976   1.641  0.00  0.00    +0.019 A 
ATOM     30  C   LIG    1       -5.603   0.510   1.223  0.00  0.00    +0.005 A 
BRANCH  28  31
ATOM     31  C   LIG    1       -8.973   2.116   1.168  0.00  0.00    +0.099 C 
ATOM     32  N   LIG    1      -10.013   2.497   1.515  0.00  0.00    -0.191 NA
ENDBRANCH  28  31
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH  21  23
ENDBRANCH  19  21
ENDBRANCH  17  19
ENDBRANCH   5  17
TORSDOF 9