REMARK  Name = BDB016992
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.171  -0.381  -0.464  0.00  0.00    +0.091 A 
ATOM      2  N   LIG    1        0.206  -1.427  -1.330  0.00  0.00    -0.253 NA
ATOM      3  C   LIG    1       -0.970  -2.007  -1.646  0.00  0.00    +0.112 A 
ATOM      4  C   LIG    1       -2.190  -1.598  -1.139  0.00  0.00    +0.031 A 
ATOM      5  C   LIG    1       -2.216  -0.522  -0.249  0.00  0.00    +0.026 A 
ATOM      6  C   LIG    1       -1.011   0.095   0.093  0.00  0.00    +0.041 A 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1        4.996   0.729  -0.220  0.00  0.00    +0.150 C 
ATOM      8  N   LIG    1        3.569   0.717  -0.030  0.00  0.00    -0.339 N 
ATOM      9  C   LIG    1        2.679  -0.137  -0.611  0.00  0.00    +0.116 A 
ATOM     10  C   LIG    1        1.443   0.243  -0.126  0.00  0.00    +0.107 A 
ATOM     11  N   LIG    1        1.580   1.313   0.737  0.00  0.00    -0.234 NA
ATOM     12  C   LIG    1        2.869   1.572   0.771  0.00  0.00    +0.199 A 
ENDBRANCH   1  10
BRANCH   5  13
ATOM     13  C   LIG    1       -3.474  -0.053   0.312  0.00  0.00    +0.204 A 
ATOM     14  N   LIG    1       -4.679  -0.587   0.040  0.00  0.00    -0.133 NA
ATOM     15  N   LIG    1       -5.462   0.198   0.795  0.00  0.00    -0.176 N 
ATOM     16  H   LIG    1       -6.470   0.079   0.837  0.00  0.00    +0.214 HD
ATOM     17  N   LIG    1       -4.840   1.151   1.494  0.00  0.00    -0.049 NA
ATOM     18  N   LIG    1       -3.558   1.002   1.193  0.00  0.00    -0.108 NA
ENDBRANCH   5  13
TORSDOF 2