REMARK  Name = BDB017073
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.864   0.110   0.026  0.00  0.00    -0.329 N 
ATOM      2  C   LIG    1        0.128   1.043   0.196  0.00  0.00    +0.117 A 
ATOM      3  C   LIG    1        1.314   0.342   0.124  0.00  0.00    +0.107 A 
ATOM      4  N   LIG    1        1.059  -0.996  -0.087  0.00  0.00    -0.234 NA
ATOM      5  C   LIG    1       -0.251  -1.099  -0.148  0.00  0.00    +0.200 A 
ENDROOT
BRANCH   3   6
ATOM      6  C   LIG    1        2.647   0.914   0.254  0.00  0.00    +0.091 A 
ATOM      7  N   LIG    1        2.725   2.253   0.472  0.00  0.00    -0.253 NA
ATOM      8  C   LIG    1        3.957   2.788   0.593  0.00  0.00    +0.112 A 
ATOM      9  C   LIG    1        5.126   2.054   0.508  0.00  0.00    +0.031 A 
ATOM     10  C   LIG    1        5.035   0.678   0.284  0.00  0.00    +0.026 A 
ATOM     11  C   LIG    1        3.770   0.101   0.154  0.00  0.00    +0.041 A 
BRANCH  10  12
ATOM     12  C   LIG    1        6.235  -0.140   0.186  0.00  0.00    +0.204 A 
ATOM     13  N   LIG    1        7.492   0.331   0.296  0.00  0.00    -0.133 NA
ATOM     14  N   LIG    1        8.185  -0.806   0.134  0.00  0.00    -0.176 N 
ATOM     15  H   LIG    1        9.200  -0.830   0.157  0.00  0.00    +0.214 HD
ATOM     16  N   LIG    1        7.463  -1.913  -0.061  0.00  0.00    -0.049 NA
ATOM     17  N   LIG    1        6.205  -1.499  -0.030  0.00  0.00    -0.108 NA
ENDBRANCH  10  12
ENDBRANCH   3   6
BRANCH   1  18
ATOM     18  C   LIG    1       -2.303   0.410   0.057  0.00  0.00    +0.121 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -3.087  -0.370  -0.995  0.00  0.00    -0.024 A 
ATOM     20  C   LIG    1       -3.509  -1.696  -0.818  0.00  0.00    +0.006 A 
ATOM     21  C   LIG    1       -4.225  -2.364  -1.817  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1       -4.525  -1.720  -3.013  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1       -4.105  -0.410  -3.216  0.00  0.00    +0.000 A 
ATOM     24  C   LIG    1       -3.391   0.257  -2.219  0.00  0.00    +0.006 A 
ENDBRANCH  18  19
BRANCH  18  26
ATOM     25  C   LIG    1       -4.307   1.020   1.525  0.00  0.00    +0.009 C 
ATOM     26  C   LIG    1       -2.869   0.487   1.509  0.00  0.00    +0.010 C 
ATOM     27  C   LIG    1       -2.778  -0.789   2.347  0.00  0.00    +0.009 C 
ENDBRANCH  18  26
ENDBRANCH   1  18
TORSDOF 5