REMARK  Name = BDB032268
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.687   0.841   0.838  0.00  0.00    +0.119 A 
ATOM      2  N   LIG    1        1.097   1.363  -0.252  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1       -0.189   1.018  -0.499  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1       -0.933   0.151   0.290  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1       -0.309  -0.361   1.427  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        1.012  -0.010   1.704  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1   7
ATOM      7  N   LIG    1        3.000   1.241   1.046  0.00  0.00    -0.329 N 
ATOM      8  H   LIG    1        3.216   1.847   0.257  0.00  0.00    +0.147 HD
BRANCH   7   9
ATOM      9  C   LIG    1        4.006   0.207   1.275  0.00  0.00    +0.106 C 
BRANCH   9  14
ATOM     10  C   LIG    1        8.501  -0.382  -0.502  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1        7.095  -0.761  -0.641  0.00  0.00    -0.305 NA
ATOM     12  C   LIG    1        6.620  -1.439   0.570  0.00  0.00    +0.084 C 
ATOM     13  C   LIG    1        5.162  -1.880   0.418  0.00  0.00    +0.020 C 
ATOM     14  C   LIG    1        4.227  -0.714   0.055  0.00  0.00    +0.008 C 
ATOM     15  C   LIG    1        4.808   0.019  -1.165  0.00  0.00    +0.020 C 
ATOM     16  C   LIG    1        6.275   0.410  -0.972  0.00  0.00    +0.084 C 
ENDBRANCH   9  14
ENDBRANCH   7   9
ENDBRANCH   1   7
BRANCH   4  17
ATOM     17  C   LIG    1       -2.354  -0.187  -0.060  0.00  0.00    +0.139 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -3.213   0.947   0.254  0.00  0.00    -0.325 N 
ATOM     19  H   LIG    1       -3.096   1.219   1.232  0.00  0.00    +0.148 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -4.574   0.652   0.155  0.00  0.00    +0.120 A 
ATOM     21  N   LIG    1       -5.275   0.768   1.295  0.00  0.00    -0.240 NA
ATOM     22  C   LIG    1       -6.604   0.498   1.240  0.00  0.00    +0.124 A 
ATOM     23  C   LIG    1       -7.296   0.125   0.084  0.00  0.00    +0.040 A 
ATOM     24  C   LIG    1       -6.540   0.011  -1.093  0.00  0.00    -0.008 A 
ATOM     25  C   LIG    1       -7.182  -0.372  -2.274  0.00  0.00    +0.028 A 
ATOM     26  C   LIG    1       -8.540  -0.632  -2.233  0.00  0.00    +0.113 A 
ATOM     27  N   LIG    1       -9.295  -0.529  -1.118  0.00  0.00    -0.240 NA
ATOM     28  C   LIG    1       -8.677  -0.146   0.014  0.00  0.00    +0.125 A 
ATOM     29  C   LIG    1       -5.164   0.285  -1.049  0.00  0.00    +0.052 A 
BRANCH  28  30
ATOM     30  N   LIG    1       -9.512  -0.042   1.130  0.00  0.00    -0.343 N 
ATOM     31  H   LIG    1       -9.485   0.893   1.521  0.00  0.00    +0.144 HD
ATOM     32  H   LIG    1      -10.449  -0.269   0.801  0.00  0.00    +0.144 HD
ENDBRANCH  28  30
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   4  17
TORSDOF 7