REMARK  Name = BDB062470
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.990   2.784  -2.088  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1        0.627   1.548  -2.800  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1       -0.180   0.537  -1.957  0.00  0.00    +0.122 C 
ATOM      4  N   LIG    1       -1.437   1.134  -1.441  0.00  0.00    -0.314 N 
ATOM      5  C   LIG    1       -1.344   2.595  -1.178  0.00  0.00    +0.122 C 
ATOM      6  C   LIG    1        0.115   3.043  -0.933  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -2.426   0.344  -0.823  0.00  0.00    +0.107 A 
ATOM      8  N   LIG    1       -3.798   0.722  -0.880  0.00  0.00    -0.287 N 
ATOM      9  C   LIG    1       -4.833   0.023  -0.249  0.00  0.00    +0.151 A 
ATOM     10  N   LIG    1       -6.003   0.615  -0.434  0.00  0.00    -0.235 NA
ATOM     11  C   LIG    1       -5.748   1.683  -1.248  0.00  0.00    +0.131 A 
ATOM     12  C   LIG    1       -4.490  -1.165   0.464  0.00  0.00    +0.079 A 
ATOM     13  C   LIG    1       -3.201  -1.559   0.494  0.00  0.00    +0.020 A 
ATOM     14  C   LIG    1       -4.413   1.755  -1.556  0.00  0.00    +0.114 A 
ATOM     15  C   LIG    1       -2.150  -0.799  -0.157  0.00  0.00    +0.043 A 
BRANCH  12  16
ATOM     16  C   LIG    1       -5.504  -2.010   1.178  0.00  0.00    +0.247 C 
ATOM     17  N   LIG    1       -6.804  -1.581   1.080  0.00  0.00    -0.314 N 
ATOM     18  H   LIG    1       -6.982  -0.700   0.596  0.00  0.00    +0.149 HD
ATOM     19  C   LIG    1       -7.883  -2.227   1.777  0.00  0.00    +0.128 C 
ATOM     20  O   LIG    1       -5.176  -3.011   1.810  0.00  0.00    -0.270 OA
ENDBRANCH  12  16
ENDBRANCH   4   7
BRANCH   1  21
ATOM     21  C   LIG    1        2.418   2.982  -1.837  0.00  0.00    +0.121 C 
BRANCH  21  31
ATOM     22  C   LIG    1        5.366  -1.676   1.645  0.00  0.00    +0.019 A 
ATOM     23  C   LIG    1        5.349  -2.106   0.208  0.00  0.00    +0.252 A 
ATOM     24  O   LIG    1        5.833  -3.171  -0.158  0.00  0.00    -0.268 OA
ATOM     25  N   LIG    1        4.762  -1.253  -0.692  0.00  0.00    -0.321 N 
ATOM     26  H   LIG    1        4.761  -1.561  -1.654  0.00  0.00    +0.169 HD
ATOM     27  C   LIG    1        4.207  -0.021  -0.330  0.00  0.00    +0.068 A 
ATOM     28  C   LIG    1        4.238   0.390   1.001  0.00  0.00    +0.088 A 
ATOM     29  N   LIG    1        3.735   1.564   1.433  0.00  0.00    -0.253 NA
ATOM     30  C   LIG    1        3.172   2.357   0.491  0.00  0.00    +0.116 A 
ATOM     31  C   LIG    1        3.075   2.034  -0.864  0.00  0.00    -0.013 A 
ATOM     32  C   LIG    1        3.623   0.813  -1.276  0.00  0.00    +0.034 A 
ATOM     33  C   LIG    1        4.846  -0.485   1.995  0.00  0.00    +0.038 A 
BRANCH  22  35
ATOM     34  C   LIG    1        5.104  -3.768   3.011  0.00  0.00    +0.009 C 
ATOM     35  C   LIG    1        6.012  -2.605   2.635  0.00  0.00    +0.037 C 
ENDBRANCH  22  35
ENDBRANCH  21  31
ENDBRANCH   1  21
TORSDOF 5