REMARK  Name = BDB007795
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.300  -0.095   0.452  0.00  0.00    +0.244 C 
ATOM      2  N   LIG    1        0.321  -0.865  -0.137  0.00  0.00    -0.309 N 
ATOM      3  H   LIG    1        0.528  -1.346  -1.004  0.00  0.00    +0.149 HD
ATOM      4  O   LIG    1        1.061   0.810   1.244  0.00  0.00    -0.270 OA
ENDROOT
BRANCH   1   9
ATOM      5  C   LIG    1        4.980   0.378  -0.132  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        5.356  -0.818  -0.635  0.00  0.00    -0.240 NA
ATOM      7  C   LIG    1        4.420  -1.778  -0.792  0.00  0.00    +0.113 A 
ATOM      8  C   LIG    1        3.090  -1.615  -0.466  0.00  0.00    +0.033 A 
ATOM      9  C   LIG    1        2.703  -0.383   0.052  0.00  0.00    +0.041 A 
ATOM     10  C   LIG    1        3.660   0.618   0.236  0.00  0.00    +0.057 A 
BRANCH   5  11
ATOM     11  N   LIG    1        5.925   1.419   0.077  0.00  0.00    -0.285 N 
ATOM     12  H   LIG    1        5.513   2.283  -0.270  0.00  0.00    +0.155 HD
BRANCH  11  15
ATOM     13  C   LIG    1        7.713  -0.775   1.283  0.00  0.00    +0.174 C 
ATOM     14  N   LIG    1        8.063   0.284   0.366  0.00  0.00    -0.254 N 
ATOM     15  C   LIG    1        7.264   1.288  -0.139  0.00  0.00    +0.122 A 
ATOM     16  C   LIG    1        8.120   2.129  -0.817  0.00  0.00    +0.065 A 
ATOM     17  C   LIG    1        9.387   1.531  -0.713  0.00  0.00    +0.136 A 
ATOM     18  N   LIG    1        9.364   0.410   0.007  0.00  0.00    -0.178 NA
ENDBRANCH  11  15
ENDBRANCH   5  11
ENDBRANCH   1   9
BRANCH   2  19
ATOM     19  C   LIG    1       -1.087  -0.542   0.042  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -1.980  -1.679  -0.466  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1       -1.539  -2.031  -1.795  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1       -2.075  -2.795  -2.076  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1       -3.483  -1.317  -0.506  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1       -4.072  -1.105   0.826  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1       -4.181   0.327   1.179  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1       -5.320   1.070   0.512  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1       -6.438   0.382   0.009  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1       -7.492   1.098  -0.575  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1       -7.447   2.490  -0.638  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1       -6.350   3.176  -0.123  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1       -6.478  -1.124   0.040  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1       -5.293   2.471   0.452  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1       -5.404  -1.723   0.961  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   2  19
TORSDOF 8