REMARK  Name = BDB022307
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.370   4.837   0.314  0.00  0.00    +0.152 C 
ATOM      2  N   LIG    1        0.283   3.551   0.130  0.00  0.00    -0.311 N 
ATOM      3  C   LIG    1       -0.462   2.341   0.251  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1        0.180   1.104   0.059  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1       -0.595  -0.076   0.107  0.00  0.00    +0.035 A 
ATOM      6  C   LIG    1       -1.968  -0.062   0.388  0.00  0.00    +0.032 A 
ATOM      7  C   LIG    1       -2.575   1.172   0.604  0.00  0.00    +0.025 A 
ATOM      8  C   LIG    1        1.642   1.058  -0.219  0.00  0.00    +0.042 A 
ATOM      9  C   LIG    1        2.276   2.229  -0.368  0.00  0.00    +0.093 A 
ATOM     10  C   LIG    1       -1.836   2.358   0.537  0.00  0.00    +0.028 A 
ATOM     11  C   LIG    1        1.624   3.545  -0.212  0.00  0.00    +0.253 A 
ATOM     12  O   LIG    1        2.310   4.553  -0.375  0.00  0.00    -0.268 OA
ENDROOT
BRANCH   6  13
ATOM     13  N   LIG    1       -2.677  -1.278   0.382  0.00  0.00    -0.313 N 
ATOM     14  H   LIG    1       -2.097  -2.076   0.635  0.00  0.00    +0.152 HD
BRANCH  13  15
ATOM     15  C   LIG    1       -4.040  -1.569   0.146  0.00  0.00    +0.053 A 
ATOM     16  C   LIG    1       -4.676  -2.653   0.782  0.00  0.00    +0.110 A 
ATOM     17  C   LIG    1       -6.028  -2.854   0.539  0.00  0.00    +0.148 A 
ATOM     18 CL   LIG    1       -6.934  -4.137   1.248  0.00  0.00    -0.061 Cl
ATOM     19  N   LIG    1       -6.783  -2.075  -0.269  0.00  0.00    -0.242 NA
ATOM     20  C   LIG    1       -6.159  -1.045  -0.868  0.00  0.00    +0.114 A 
ATOM     21  C   LIG    1       -4.817  -0.755  -0.689  0.00  0.00    +0.044 A 
BRANCH  16  22
ATOM     22  C   LIG    1       -3.953  -3.521   1.655  0.00  0.00    +0.104 C 
ATOM     23  N   LIG    1       -3.310  -4.203   2.341  0.00  0.00    -0.191 NA
ENDBRANCH  16  22
ENDBRANCH  13  15
ENDBRANCH   6  13
BRANCH   8  24
ATOM     24  N   LIG    1        2.248  -0.197  -0.294  0.00  0.00    -0.338 N 
ATOM     25  H   LIG    1        1.895  -0.808   0.442  0.00  0.00    +0.146 HD
BRANCH  24  26
ATOM     26  CA  LIG    1        3.675  -0.461  -0.546  0.00  0.00    +0.099 C 
BRANCH  26  27
ATOM     27  C   LIG    1        3.962  -1.870  -0.078  0.00  0.00    +0.011 C 
ATOM     28  C   LIG    1        4.115  -2.171   1.394  0.00  0.00    +0.006 C 
ATOM     29  C   LIG    1        5.313  -2.233   0.487  0.00  0.00    +0.006 C 
ENDBRANCH  26  27
BRANCH  26  30
ATOM     30  C   LIG    1        3.976  -0.325  -2.056  0.00  0.00    +0.178 C 
BRANCH  30  31
ATOM     31  O   LIG    1        2.980  -1.002  -2.830  0.00  0.00    -0.393 OA
ATOM     32  H   LIG    1        2.140  -0.788  -2.373  0.00  0.00    +0.209 HD
ENDBRANCH  30  31
ENDBRANCH  26  30
ENDBRANCH  24  26
ENDBRANCH   8  24
TORSDOF 8