REMARK  Name = BDB013676
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.246   3.213   0.522  0.00  0.00    +0.176 C 
ATOM      2  N   LIG    1       -1.266   1.775   0.325  0.00  0.00    -0.230 N 
ATOM      3  C   LIG    1       -2.473   1.083   0.363  0.00  0.00    +0.276 A 
ATOM      4  O   LIG    1       -3.574   1.600   0.534  0.00  0.00    -0.266 OA
ATOM      5  C   LIG    1       -2.397  -0.367   0.174  0.00  0.00    +0.070 A 
ATOM      6  C   LIG    1       -1.169  -0.960   0.012  0.00  0.00    +0.117 A 
ATOM      7  N   LIG    1       -0.970  -2.296  -0.197  0.00  0.00    -0.251 NA
ATOM      8  C   LIG    1       -2.086  -3.058  -0.224  0.00  0.00    +0.111 A 
ATOM      9  C   LIG    1       -3.370  -2.554  -0.062  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        0.049  -0.110   0.048  0.00  0.00    +0.166 A 
ATOM     11  C   LIG    1       -3.528  -1.183   0.139  0.00  0.00    +0.017 A 
ATOM     12  N   LIG    1       -0.032   1.182   0.195  0.00  0.00    -0.151 NA
ENDROOT
BRANCH  10  13
ATOM     13  N   LIG    1        1.262  -0.772  -0.076  0.00  0.00    -0.321 N 
ATOM     14  H   LIG    1        1.147  -1.733  -0.399  0.00  0.00    +0.148 HD
BRANCH  13  15
ATOM     15  C   LIG    1        2.331  -0.050  -0.706  0.00  0.00    +0.099 C 
ATOM     16  C   LIG    1        3.686  -0.792  -0.611  0.00  0.00    +0.104 C 
ATOM     17  N   LIG    1        4.329   0.509  -0.319  0.00  0.00    -0.312 NA
ATOM     18  H   LIG    1        5.067   0.473   0.382  0.00  0.00    +0.122 HD
ATOM     19  C   LIG    1        3.024   0.998   0.196  0.00  0.00    +0.104 C 
ENDBRANCH  13  15
ENDBRANCH  10  13
TORSDOF 2