REMARK  Name = BDB014716
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.024  -0.187  -0.190  0.00  0.00    -0.283 N 
ATOM      2  H   LIG    1       -0.087   0.110   0.768  0.00  0.00    +0.155 HD
ENDROOT
BRANCH   1   8
ATOM      3  C   LIG    1       -4.209   1.700   2.941  0.00  0.00    +0.109 C 
ATOM      4  C   LIG    1       -5.036   0.876   1.986  0.00  0.00    +0.213 C 
ATOM      5  N   LIG    1       -4.361   0.230   0.957  0.00  0.00    -0.297 N 
ATOM      6  C   LIG    1       -2.889   0.090   0.947  0.00  0.00    +0.148 C 
ATOM      7  C   LIG    1       -2.401  -0.291  -0.403  0.00  0.00    +0.032 A 
ATOM      8  C   LIG    1       -1.087  -0.441  -0.921  0.00  0.00    +0.151 A 
ATOM      9  N   LIG    1       -1.128  -0.789  -2.212  0.00  0.00    -0.156 NA
ATOM     10  N   LIG    1       -2.433  -0.909  -2.506  0.00  0.00    -0.269 N 
ATOM     11  C   LIG    1       -2.814  -1.305  -3.839  0.00  0.00    +0.172 C 
ATOM     12  C   LIG    1       -3.236  -0.623  -1.449  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.715  -0.635  -1.383  0.00  0.00    +0.074 C 
ATOM     14  C   LIG    1       -5.136  -0.692   0.100  0.00  0.00    +0.114 C 
ATOM     15  O   LIG    1       -6.257   0.810   2.130  0.00  0.00    -0.276 OA
ENDBRANCH   1   8
BRANCH   1  16
ATOM     16  C   LIG    1        1.293  -0.796  -0.338  0.00  0.00    +0.125 A 
ATOM     17  N   LIG    1        1.417  -2.022  -0.883  0.00  0.00    -0.240 NA
ATOM     18  C   LIG    1        2.652  -2.553  -0.989  0.00  0.00    +0.113 A 
ATOM     19  C   LIG    1        3.802  -1.923  -0.555  0.00  0.00    +0.028 A 
ATOM     20  C   LIG    1        3.682  -0.658   0.015  0.00  0.00    -0.010 A 
ATOM     21  C   LIG    1        2.407  -0.094   0.124  0.00  0.00    +0.052 A 
BRANCH  20  22
ATOM     22  C   LIG    1        4.861   0.047   0.485  0.00  0.00    +0.020 A 
ATOM     23  C   LIG    1        5.025   1.417   0.479  0.00  0.00    +0.116 A 
ATOM     24  N   LIG    1        6.273   1.657   0.979  0.00  0.00    -0.274 N 
ATOM     25  C   LIG    1        6.907   2.941   1.156  0.00  0.00    +0.172 C 
ATOM     26  N   LIG    1        6.938   0.539   1.318  0.00  0.00    -0.179 NA
ATOM     27  C   LIG    1        6.082  -0.439   1.010  0.00  0.00    +0.142 A 
ENDBRANCH  20  22
ENDBRANCH   1  16
TORSDOF 3