REMARK  Name = BDB022310
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.931   1.066  -0.782  0.00  0.00    +0.042 A 
ATOM      2  C   LIG    1        0.248   1.458   0.040  0.00  0.00    +0.021 A 
ATOM      3  C   LIG    1        0.356   2.770   0.537  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        1.462   3.108   1.332  0.00  0.00    +0.028 A 
ATOM      5  C   LIG    1        2.462   2.172   1.612  0.00  0.00    +0.025 A 
ATOM      6  C   LIG    1        2.391   0.874   1.107  0.00  0.00    +0.032 A 
ATOM      7  N   LIG    1       -0.642   3.735   0.208  0.00  0.00    -0.311 N 
ATOM      8  C   LIG    1       -0.538   5.097   0.706  0.00  0.00    +0.152 C 
ATOM      9  C   LIG    1       -1.706   3.424  -0.620  0.00  0.00    +0.253 A 
ATOM     10  O   LIG    1       -2.572   4.221  -0.976  0.00  0.00    -0.268 OA
ATOM     11  C   LIG    1        1.284   0.539   0.320  0.00  0.00    +0.035 A 
ATOM     12  C   LIG    1       -1.809   2.028  -1.093  0.00  0.00    +0.093 A 
ENDROOT
BRANCH   1  13
ATOM     13  N   LIG    1       -1.036  -0.273  -1.167  0.00  0.00    -0.335 N 
ATOM     14  H   LIG    1       -0.792  -0.883  -0.380  0.00  0.00    +0.147 HD
BRANCH  13  16
ATOM     15  C   LIG    1       -1.683  -2.096  -2.641  0.00  0.00    +0.034 C 
ATOM     16  C   LIG    1       -2.186  -0.892  -1.843  0.00  0.00    +0.116 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -3.210  -1.345  -0.809  0.00  0.00    +0.061 A 
ATOM     18  N   LIG    1       -2.746  -2.054   0.259  0.00  0.00    -0.258 NA
ATOM     19  C   LIG    1       -3.650  -2.447   1.182  0.00  0.00    +0.111 A 
ATOM     20  C   LIG    1       -5.004  -2.173   1.099  0.00  0.00    +0.020 A 
ATOM     21  C   LIG    1       -5.463  -1.451   0.004  0.00  0.00    +0.003 A 
ATOM     22  C   LIG    1       -4.558  -1.028  -0.966  0.00  0.00    +0.025 A 
ENDBRANCH  16  17
ENDBRANCH  13  16
ENDBRANCH   1  13
BRANCH   6  23
ATOM     23  N   LIG    1        3.456  -0.012   1.357  0.00  0.00    -0.313 N 
ATOM     24  H   LIG    1        3.926   0.178   2.241  0.00  0.00    +0.152 HD
BRANCH  23  25
ATOM     25  C   LIG    1        3.920  -1.146   0.650  0.00  0.00    +0.053 A 
ATOM     26  C   LIG    1        4.525  -2.227   1.318  0.00  0.00    +0.110 A 
ATOM     27  C   LIG    1        4.916  -3.326   0.564  0.00  0.00    +0.148 A 
ATOM     28 CL   LIG    1        5.671  -4.717   1.248  0.00  0.00    -0.061 Cl
ATOM     29  N   LIG    1        4.755  -3.433  -0.774  0.00  0.00    -0.242 NA
ATOM     30  C   LIG    1        4.173  -2.392  -1.395  0.00  0.00    +0.114 A 
ATOM     31  C   LIG    1        3.745  -1.251  -0.736  0.00  0.00    +0.044 A 
BRANCH  26  32
ATOM     32  C   LIG    1        4.731  -2.199   2.730  0.00  0.00    +0.104 C 
ATOM     33  N   LIG    1        4.894  -2.114   3.876  0.00  0.00    -0.191 NA
ENDBRANCH  26  32
ENDBRANCH  23  25
ENDBRANCH   6  23
TORSDOF 6