REMARK  Name = BDB032294
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.024   0.661  -0.882  0.00  0.00    +0.122 A 
ATOM      2  N   LIG    1        1.418   1.319   0.129  0.00  0.00    -0.240 NA
ATOM      3  C   LIG    1        0.108   1.642  -0.001  0.00  0.00    +0.118 A 
ATOM      4  C   LIG    1       -0.660   1.358  -1.121  0.00  0.00    -0.012 A 
ATOM      5  C   LIG    1       -0.028   0.688  -2.164  0.00  0.00    +0.010 A 
ATOM      6  C   LIG    1        1.319   0.344  -2.046  0.00  0.00    +0.044 A 
ENDROOT
BRANCH   1  11
ATOM      7  C   LIG    1        6.995  -1.383   0.332  0.00  0.00    +0.318 A 
ATOM      8  N   LIG    1        5.856  -0.690   0.086  0.00  0.00    -0.278 N 
ATOM      9  C   LIG    1        5.555   0.696   0.350  0.00  0.00    +0.147 C 
ATOM     10  C   LIG    1        4.040   0.920   0.414  0.00  0.00    +0.128 C 
ATOM     11  N   LIG    1        3.386   0.322  -0.771  0.00  0.00    -0.306 N 
ATOM     12  C   LIG    1        3.615  -1.139  -0.901  0.00  0.00    +0.182 C 
ATOM     13  C   LIG    1        4.991  -1.564  -0.509  0.00  0.00    +0.154 A 
ATOM     14  N   LIG    1        5.574  -2.740  -0.613  0.00  0.00    -0.130 NA
ATOM     15  N   LIG    1        6.846  -2.623  -0.081  0.00  0.00    -0.092 NA
BRANCH   7  17
ATOM     16  C   LIG    1        9.155  -1.746   1.061  0.00  0.00    +0.280 C 
ATOM     17  O   LIG    1        8.066  -0.842   0.903  0.00  0.00    -0.466 OA
ENDBRANCH   7  17
ENDBRANCH   1  11
BRANCH   4  18
ATOM     18  C   LIG    1       -2.109   1.752  -1.182  0.00  0.00    +0.138 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -2.875   0.892  -0.291  0.00  0.00    -0.339 N 
ATOM     20  H   LIG    1       -2.608  -0.084  -0.393  0.00  0.00    +0.146 HD
BRANCH  19  21
ATOM     21  C   LIG    1       -4.277   1.014  -0.202  0.00  0.00    +0.035 A 
ATOM     22  C   LIG    1       -5.021   0.065   0.570  0.00  0.00    +0.008 A 
ATOM     23  C   LIG    1       -6.430   0.182   0.667  0.00  0.00    +0.023 A 
ATOM     24  C   LIG    1       -7.132  -0.797   1.405  0.00  0.00    +0.124 A 
ATOM     25  N   LIG    1       -6.542  -1.815   2.056  0.00  0.00    -0.240 NA
ATOM     26  C   LIG    1       -5.202  -1.887   1.984  0.00  0.00    +0.113 A 
ATOM     27  C   LIG    1       -7.070   1.272   0.045  0.00  0.00    +0.012 A 
ATOM     28  C   LIG    1       -6.343   2.229  -0.652  0.00  0.00    +0.003 A 
ATOM     29  C   LIG    1       -4.418  -0.999   1.269  0.00  0.00    +0.030 A 
ATOM     30  C   LIG    1       -4.961   2.104  -0.763  0.00  0.00    +0.023 A 
BRANCH  24  31
ATOM     31  N   LIG    1       -8.527  -0.776   1.522  0.00  0.00    -0.343 N 
ATOM     32  H   LIG    1       -8.771  -1.599   2.071  0.00  0.00    +0.144 HD
ATOM     33  H   LIG    1       -8.959  -0.803   0.607  0.00  0.00    +0.144 HD
ENDBRANCH  24  31
ENDBRANCH  19  21
ENDBRANCH  18  19
ENDBRANCH   4  18
TORSDOF 6