REMARK  Name = BDB022215
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.960  -1.250  -0.306  0.00  0.00    +0.042 A 
ATOM      2  C   LIG    1        0.440  -1.008   0.141  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1        0.943  -1.659   1.282  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        2.256  -1.388   1.698  0.00  0.00    +0.028 A 
ATOM      5  C   LIG    1        3.073  -0.502   0.986  0.00  0.00    +0.025 A 
ATOM      6  C   LIG    1        2.611   0.121  -0.170  0.00  0.00    +0.032 A 
ATOM      7  N   LIG    1        0.123  -2.593   1.980  0.00  0.00    -0.311 N 
ATOM      8  C   LIG    1        0.636  -3.289   3.150  0.00  0.00    +0.152 C 
ATOM      9  C   LIG    1       -1.155  -2.901   1.547  0.00  0.00    +0.253 A 
ATOM     10  O   LIG    1       -1.892  -3.725   2.086  0.00  0.00    -0.268 OA
ATOM     11  C   LIG    1        1.295  -0.141  -0.575  0.00  0.00    +0.035 A 
ATOM     12  C   LIG    1       -1.665  -2.168   0.370  0.00  0.00    +0.093 A 
ENDROOT
BRANCH   1  13
ATOM     13  N   LIG    1       -1.422  -0.485  -1.379  0.00  0.00    -0.334 N 
ATOM     14  H   LIG    1       -1.215   0.500  -1.197  0.00  0.00    +0.147 HD
BRANCH  13  15
ATOM     15  C   LIG    1       -2.744  -0.550  -2.045  0.00  0.00    +0.135 C 
ATOM     16  C   LIG    1       -2.944  -1.884  -2.764  0.00  0.00    +0.036 C 
BRANCH  15  20
ATOM     17  C   LIG    1       -4.779   2.928   0.720  0.00  0.00    +0.066 C 
ATOM     18  C   LIG    1       -4.829   1.528   0.187  0.00  0.00    +0.042 A 
ATOM     19  N   LIG    1       -3.846   1.149  -0.656  0.00  0.00    -0.235 NA
ATOM     20  C   LIG    1       -3.890  -0.120  -1.129  0.00  0.00    +0.149 A 
ATOM     21  N   LIG    1       -4.853  -1.011  -0.817  0.00  0.00    -0.238 NA
ATOM     22  C   LIG    1       -5.810  -0.589   0.028  0.00  0.00    +0.114 A 
ATOM     23  C   LIG    1       -5.847   0.676   0.564  0.00  0.00    +0.043 A 
ENDBRANCH  15  20
ENDBRANCH  13  15
ENDBRANCH   1  13
BRANCH   6  24
ATOM     24  N   LIG    1        3.382   1.035  -0.914  0.00  0.00    -0.313 N 
ATOM     25  H   LIG    1        3.135   1.040  -1.902  0.00  0.00    +0.152 HD
BRANCH  24  26
ATOM     26  C   LIG    1        4.477   1.852  -0.550  0.00  0.00    +0.053 A 
ATOM     27  C   LIG    1        5.484   2.183  -1.477  0.00  0.00    +0.110 A 
ATOM     28  C   LIG    1        6.551   2.955  -1.036  0.00  0.00    +0.148 A 
ATOM     29 CL   LIG    1        7.853   3.436  -2.058  0.00  0.00    -0.061 Cl
ATOM     30  N   LIG    1        6.693   3.414   0.228  0.00  0.00    -0.242 NA
ATOM     31  C   LIG    1        5.721   3.088   1.099  0.00  0.00    +0.114 A 
ATOM     32  C   LIG    1        4.618   2.321   0.763  0.00  0.00    +0.044 A 
BRANCH  27  33
ATOM     33  C   LIG    1        5.415   1.739  -2.832  0.00  0.00    +0.104 C 
ATOM     34  N   LIG    1        5.302   1.369  -3.926  0.00  0.00    -0.191 NA
ENDBRANCH  27  33
ENDBRANCH  24  26
ENDBRANCH   6  24
TORSDOF 6