REMARK  Name = BDB022366
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.916  -4.721  -0.152  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1       -0.292  -3.415  -0.288  0.00  0.00    -0.311 N 
ATOM      3  C   LIG    1       -1.081  -2.230  -0.222  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1       -0.466  -0.974  -0.374  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1       -1.278   0.182  -0.376  0.00  0.00    +0.035 A 
ATOM      6  C   LIG    1       -2.667   0.125  -0.194  0.00  0.00    +0.032 A 
ATOM      7  C   LIG    1       -3.248  -1.126  -0.004  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1        1.009  -0.879  -0.552  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1        1.690  -2.029  -0.643  0.00  0.00    +0.093 A 
ATOM     10  C   LIG    1       -2.470  -2.288  -0.027  0.00  0.00    +0.028 A 
ATOM     11  C   LIG    1        1.071  -3.366  -0.526  0.00  0.00    +0.253 A 
ATOM     12  O   LIG    1        1.797  -4.354  -0.629  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   6  13
ATOM     13  N   LIG    1       -3.397   1.329  -0.159  0.00  0.00    -0.313 N 
ATOM     14  H   LIG    1       -2.985   2.052  -0.747  0.00  0.00    +0.152 HD
BRANCH  13  15
ATOM     15  C   LIG    1       -4.632   1.659   0.445  0.00  0.00    +0.053 A 
ATOM     16  C   LIG    1       -5.490   2.622  -0.119  0.00  0.00    +0.110 A 
ATOM     17  C   LIG    1       -6.706   2.863   0.508  0.00  0.00    +0.148 A 
ATOM     18 CL   LIG    1       -7.853   4.013  -0.070  0.00  0.00    -0.061 Cl
ATOM     19  N   LIG    1       -7.126   2.235   1.629  0.00  0.00    -0.242 NA
ATOM     20  C   LIG    1       -6.293   1.320   2.155  0.00  0.00    +0.114 A 
ATOM     21  C   LIG    1       -5.062   1.002   1.606  0.00  0.00    +0.044 A 
BRANCH  16  22
ATOM     22  C   LIG    1       -5.126   3.332  -1.303  0.00  0.00    +0.104 C 
ATOM     23  N   LIG    1       -4.772   3.894  -2.255  0.00  0.00    -0.191 NA
ENDBRANCH  16  22
ENDBRANCH  13  15
ENDBRANCH   6  13
BRANCH   8  24
ATOM     24  N   LIG    1        1.560   0.405  -0.591  0.00  0.00    -0.329 N 
ATOM     25  H   LIG    1        1.213   0.938   0.211  0.00  0.00    +0.147 HD
BRANCH  24  26
ATOM     26  C   LIG    1        2.992   0.762  -0.790  0.00  0.00    +0.117 C 
ATOM     27  C   LIG    1        3.553   0.269  -2.138  0.00  0.00    +0.193 C 
ATOM     28  O   LIG    1        4.392   1.304  -2.701  0.00  0.00    -0.377 OA
ATOM     29  C   LIG    1        4.346   2.429  -1.821  0.00  0.00    +0.162 C 
ATOM     30  C   LIG    1        3.080   2.276  -1.009  0.00  0.00    +0.064 C 
BRANCH  26  31
ATOM     31  C   LIG    1        3.831   0.384   0.442  0.00  0.00    +0.154 A 
ATOM     32  N   LIG    1        3.412   0.865   1.638  0.00  0.00    -0.238 NA
ATOM     33  C   LIG    1        4.122   0.498   2.721  0.00  0.00    +0.114 A 
ATOM     34  C   LIG    1        5.223  -0.321   2.665  0.00  0.00    +0.039 A 
ATOM     35  C   LIG    1        5.572  -0.758   1.411  0.00  0.00    +0.114 A 
ATOM     36  N   LIG    1        4.900  -0.424   0.294  0.00  0.00    -0.238 NA
ENDBRANCH  26  31
ENDBRANCH  24  26
ENDBRANCH   8  24
TORSDOF 6