REMARK  Name = BDB014806
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.796   0.015   0.337  0.00  0.00    -0.298 N 
ATOM      2  H   LIG    1       -1.004   0.383   1.257  0.00  0.00    +0.154 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -1.842  -0.181  -0.504  0.00  0.00    +0.150 A 
ATOM      4  C   LIG    1       -3.171   0.175  -0.145  0.00  0.00    +0.032 A 
ATOM      5  C   LIG    1       -3.717   0.800   1.088  0.00  0.00    +0.148 C 
ATOM      6  N   LIG    1       -5.192   0.830   1.056  0.00  0.00    -0.297 N 
ATOM      7  C   LIG    1       -5.841   1.048  -0.257  0.00  0.00    +0.114 C 
ATOM      8  C   LIG    1       -5.409   0.020  -1.325  0.00  0.00    +0.074 C 
ATOM      9  C   LIG    1       -5.814   1.096   2.269  0.00  0.00    +0.213 C 
ATOM     10  O   LIG    1       -5.185   1.212   3.322  0.00  0.00    -0.276 OA
ATOM     11  C   LIG    1       -7.315   1.229   2.266  0.00  0.00    +0.109 C 
ATOM     12  C   LIG    1       -3.943  -0.165  -1.235  0.00  0.00    +0.047 A 
ATOM     13  N   LIG    1       -3.097  -0.705  -2.148  0.00  0.00    -0.269 N 
ATOM     14  C   LIG    1       -3.411  -1.240  -3.450  0.00  0.00    +0.172 C 
ATOM     15  N   LIG    1       -1.819  -0.702  -1.736  0.00  0.00    -0.156 NA
ENDBRANCH   1   3
BRANCH   1  19
ATOM     16  C   LIG    1        3.400  -0.692   0.028  0.00  0.00    -0.018 A 
ATOM     17  C   LIG    1        2.819  -0.181   1.195  0.00  0.00    +0.010 A 
ATOM     18  C   LIG    1        1.438   0.043   1.274  0.00  0.00    +0.024 A 
ATOM     19  C   LIG    1        0.587  -0.235   0.192  0.00  0.00    +0.032 A 
ATOM     20  C   LIG    1        1.171  -0.743  -0.970  0.00  0.00    +0.024 A 
ATOM     21  C   LIG    1        2.553  -0.969  -1.053  0.00  0.00    +0.010 A 
BRANCH  16  24
ATOM     22  C   LIG    1        7.147  -0.116   0.114  0.00  0.00    +0.121 A 
ATOM     23  C   LIG    1        5.769   0.106   0.196  0.00  0.00    +0.054 A 
ATOM     24  C   LIG    1        4.850  -0.930  -0.060  0.00  0.00    -0.014 A 
ATOM     25  C   LIG    1        5.351  -2.197  -0.402  0.00  0.00    +0.009 A 
ATOM     26  C   LIG    1        6.724  -2.425  -0.482  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        7.616  -1.386  -0.224  0.00  0.00    +0.045 A 
BRANCH  22  29
ATOM     28  C   LIG    1        7.701   2.131   0.659  0.00  0.00    +0.277 C 
ATOM     29  O   LIG    1        8.126   0.813   0.339  0.00  0.00    -0.495 OA
ENDBRANCH  22  29
ENDBRANCH  16  24
ENDBRANCH   1  19
TORSDOF 4