REMARK  Name = BDB014375
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -1.899  -1.840   0.522  0.00  0.00    -0.312 N 
ATOM      2  C   LIG    1       -0.689  -1.497   1.321  0.00  0.00    +0.125 C 
ATOM      3  C   LIG    1        0.611  -2.036   0.682  0.00  0.00    +0.127 C 
ATOM      4  N   LIG    1        0.775  -1.526  -0.696  0.00  0.00    -0.298 N 
ATOM      5  C   LIG    1       -0.467  -1.435  -1.493  0.00  0.00    +0.127 C 
ATOM      6  C   LIG    1       -1.607  -2.265  -0.867  0.00  0.00    +0.125 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        1.853  -0.747  -0.965  0.00  0.00    +0.197 A 
ATOM      8  N   LIG    1        2.004  -0.108  -2.171  0.00  0.00    -0.326 N 
ATOM      9  H   LIG    1        1.357  -0.156  -2.940  0.00  0.00    +0.169 HD
ATOM     10  C   LIG    1        3.180   0.598  -2.157  0.00  0.00    +0.068 A 
ATOM     11  C   LIG    1        3.720   0.338  -0.902  0.00  0.00    +0.103 A 
ATOM     12  C   LIG    1        4.957   0.920  -0.558  0.00  0.00    +0.064 A 
ATOM     13  C   LIG    1        5.593   1.746  -1.502  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1        5.019   1.986  -2.753  0.00  0.00    +0.003 A 
ATOM     15  C   LIG    1        3.794   1.413  -3.110  0.00  0.00    +0.028 A 
ATOM     16  N   LIG    1        2.883  -0.500  -0.187  0.00  0.00    -0.214 NA
BRANCH  12  17
ATOM     17  C   LIG    1        5.599   0.686   0.757  0.00  0.00    +0.244 C 
ATOM     18  O   LIG    1        6.672   1.202   1.048  0.00  0.00    -0.270 OA
ATOM     19  N   LIG    1        4.951  -0.131   1.636  0.00  0.00    -0.325 N 
ATOM     20  H   LIG    1        4.072  -0.579   1.382  0.00  0.00    +0.145 HD
ATOM     21  H   LIG    1        5.378  -0.329   2.529  0.00  0.00    +0.145 HD
ENDBRANCH  12  17
ENDBRANCH   4   7
BRANCH   1  25
ATOM     22  C   LIG    1       -4.897   1.064   0.857  0.00  0.00    +0.055 A 
ATOM     23  C   LIG    1       -4.326   0.701  -0.352  0.00  0.00    +0.126 A 
ATOM     24  N   LIG    1       -3.356  -0.241  -0.487  0.00  0.00    -0.240 NA
ATOM     25  C   LIG    1       -2.901  -0.858   0.625  0.00  0.00    +0.121 A 
ATOM     26  C   LIG    1       -3.427  -0.539   1.881  0.00  0.00    +0.044 A 
ATOM     27  C   LIG    1       -4.427   0.430   2.002  0.00  0.00    +0.018 A 
BRANCH  22  31
ATOM     28  N   LIG    1       -6.743   2.208   1.970  0.00  0.00    -0.325 N 
ATOM     29  H   LIG    1       -6.811   1.483   2.669  0.00  0.00    +0.145 HD
ATOM     30  H   LIG    1       -7.521   2.853   1.898  0.00  0.00    +0.145 HD
ATOM     31  C   LIG    1       -5.949   2.104   0.862  0.00  0.00    +0.243 C 
ATOM     32  O   LIG    1       -6.126   2.835  -0.104  0.00  0.00    -0.270 OA
ENDBRANCH  22  31
ENDBRANCH   1  25
TORSDOF 4