REMARK  Name = BDB057832
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -2.786   0.235  -1.108  0.00  0.00    +0.182 A 
ATOM      2  N   LIG    1       -3.136   1.307  -1.752  0.00  0.00    -0.146 NA
ATOM      3  N   LIG    1       -2.131   2.161  -1.982  0.00  0.00    -0.235 N 
ATOM      4  C   LIG    1       -0.841   1.963  -1.598  0.00  0.00    +0.105 A 
ATOM      5  C   LIG    1       -0.095   3.057  -1.990  0.00  0.00    +0.033 A 
ATOM      6  C   LIG    1       -0.981   3.946  -2.648  0.00  0.00    +0.022 A 
ATOM      7  C   LIG    1       -0.533   0.751  -0.908  0.00  0.00    +0.147 A 
ATOM      8  C   LIG    1       -2.230   3.364  -2.628  0.00  0.00    +0.113 A 
ATOM      9  N   LIG    1       -1.509  -0.078  -0.687  0.00  0.00    -0.209 NA
ENDROOT
BRANCH   1  11
ATOM     10  C   LIG    1       -5.069  -0.494  -0.219  0.00  0.00    -0.034 A 
ATOM     11  C   LIG    1       -3.813  -0.801  -0.789  0.00  0.00    +0.024 A 
ATOM     12  C   LIG    1       -3.484  -2.129  -1.114  0.00  0.00    +0.012 A 
ATOM     13  C   LIG    1       -4.399  -3.158  -0.906  0.00  0.00    +0.001 A 
ATOM     14  C   LIG    1       -5.651  -2.868  -0.377  0.00  0.00    +0.000 A 
ATOM     15  C   LIG    1       -5.982  -1.553  -0.040  0.00  0.00    +0.004 A 
BRANCH  10  17
ATOM     16  C   LIG    1       -6.043   0.970   1.625  0.00  0.00    +0.012 C 
ATOM     17  C   LIG    1       -5.454   0.917   0.209  0.00  0.00    +0.014 C 
ATOM     18  C   LIG    1       -6.423   1.542  -0.797  0.00  0.00    +0.012 C 
ENDBRANCH  10  17
ENDBRANCH   1  11
BRANCH   7  19
ATOM     19  N   LIG    1        0.742   0.457  -0.492  0.00  0.00    -0.323 N 
ATOM     20  H   LIG    1        1.488   1.000  -0.907  0.00  0.00    +0.148 HD
BRANCH  19  21
ATOM     21  C   LIG    1        1.121  -0.862  -0.040  0.00  0.00    +0.138 C 
BRANCH  21  22
ATOM     22  C   LIG    1        2.577  -0.853   0.358  0.00  0.00    -0.030 A 
ATOM     23  C   LIG    1        3.561  -1.334  -0.513  0.00  0.00    +0.006 A 
ATOM     24  C   LIG    1        4.910  -1.301  -0.147  0.00  0.00    +0.009 A 
ATOM     25  C   LIG    1        5.315  -0.779   1.093  0.00  0.00    -0.016 A 
ATOM     26  C   LIG    1        4.321  -0.290   1.955  0.00  0.00    +0.009 A 
ATOM     27  C   LIG    1        2.970  -0.323   1.593  0.00  0.00    +0.006 A 
BRANCH  25  28
ATOM     28  C   LIG    1        6.734  -0.744   1.473  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        7.349   0.426   1.924  0.00  0.00    +0.119 A 
ATOM     30  N   LIG    1        8.651   0.527   2.292  0.00  0.00    -0.263 NA
ATOM     31  C   LIG    1        9.390  -0.597   2.208  0.00  0.00    +0.111 A 
ATOM     32  C   LIG    1        8.891  -1.812   1.773  0.00  0.00    +0.020 A 
ATOM     33  C   LIG    1        7.548  -1.882   1.403  0.00  0.00    +0.011 A 
ENDBRANCH  25  28
ENDBRANCH  21  22
ENDBRANCH  19  21
ENDBRANCH   7  19
TORSDOF 6