REMARK  Name = BDB004870
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.534   0.034  -0.330  0.00  0.00    -0.320 N 
ATOM      2  H   LIG    1       -0.505   0.624  -1.157  0.00  0.00    +0.148 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        0.607   0.296   0.455  0.00  0.00    +0.130 A 
ATOM      4  C   LIG    1        1.883   0.239  -0.147  0.00  0.00    +0.041 A 
ATOM      5  C   LIG    1        2.988   0.518   0.682  0.00  0.00    +0.088 A 
ATOM      6  C   LIG    1        4.271   0.482   0.096  0.00  0.00    +0.063 A 
ATOM      7  C   LIG    1        4.446   0.164  -1.266  0.00  0.00    +0.015 A 
ATOM      8  C   LIG    1        3.356  -0.128  -2.068  0.00  0.00    +0.002 A 
ATOM      9  N   LIG    1        2.803   0.801   1.991  0.00  0.00    -0.235 NA
ATOM     10  C   LIG    1        1.552   0.791   2.464  0.00  0.00    +0.223 A 
ATOM     11  C   LIG    1        2.085  -0.093  -1.512  0.00  0.00    +0.013 A 
ATOM     12  N   LIG    1        0.449   0.544   1.762  0.00  0.00    -0.220 NA
BRANCH   6  13
ATOM     13  C   LIG    1        5.529   0.769   0.855  0.00  0.00    +0.244 C 
ATOM     14  O   LIG    1        6.631   0.701   0.321  0.00  0.00    -0.270 OA
ATOM     15  N   LIG    1        5.432   1.115   2.169  0.00  0.00    -0.325 N 
ATOM     16  H   LIG    1        6.277   1.284   2.696  0.00  0.00    +0.145 HD
ATOM     17  H   LIG    1        4.530   1.143   2.635  0.00  0.00    +0.145 HD
ENDBRANCH   6  13
ENDBRANCH   1   3
BRANCH   1  18
ATOM     18  C   LIG    1       -1.851   0.118   0.321  0.00  0.00    +0.116 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -2.385   1.543   0.178  0.00  0.00    -0.026 A 
ATOM     20  C   LIG    1       -2.361   2.405   1.286  0.00  0.00    +0.005 A 
ATOM     21  C   LIG    1       -2.825   3.717   1.182  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -3.314   4.190  -0.033  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -3.335   3.353  -1.146  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -2.870   2.040  -1.045  0.00  0.00    +0.005 A 
ENDBRANCH  18  19
BRANCH  18  25
ATOM     25  C   LIG    1       -2.829  -0.931  -0.314  0.00  0.00    +0.108 C 
BRANCH  25  26
ATOM     26  N   LIG    1       -2.664  -2.345   0.080  0.00  0.00    -0.312 NA
ATOM     27  H   LIG    1       -2.704  -2.401   1.099  0.00  0.00    +0.122 HD
BRANCH  26  29
ATOM     28  C   LIG    1       -1.297  -3.042  -1.895  0.00  0.00    +0.023 C 
ATOM     29  C   LIG    1       -1.428  -2.995  -0.372  0.00  0.00    +0.048 C 
ATOM     30  C   LIG    1       -1.426  -4.425   0.180  0.00  0.00    +0.023 C 
ENDBRANCH  26  29
ENDBRANCH  25  26
ENDBRANCH  18  25
ENDBRANCH   1  18
TORSDOF 7