REMARK  Name = BDB012483
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1        0.725  -2.037  -0.811  0.00  0.00    -0.270 OA
ATOM      2  C   LIG    1        0.312  -1.976   0.339  0.00  0.00    +0.250 C 
ATOM      3  C   LIG    1       -1.130  -2.133   0.589  0.00  0.00    +0.037 A 
ATOM      4  C   LIG    1       -1.825  -1.008   1.037  0.00  0.00    +0.018 A 
ATOM      5  C   LIG    1       -3.224  -1.009   1.070  0.00  0.00    -0.025 A 
ATOM      6  C   LIG    1       -3.908  -2.182   0.723  0.00  0.00    +0.005 A 
ATOM      7  C   LIG    1       -3.202  -3.321   0.315  0.00  0.00    +0.001 A 
ATOM      8  C   LIG    1       -3.951   0.297   1.312  0.00  0.00    +0.182 C 
ATOM      9  N   LIG    1       -3.946   1.116   0.098  0.00  0.00    -0.222 N 
ATOM     10  N   LIG    1       -2.722   1.675  -0.269  0.00  0.00    -0.130 NA
ATOM     11  C   LIG    1       -2.661   2.208  -1.441  0.00  0.00    +0.233 A 
ATOM     12  C   LIG    1       -3.759   2.336  -2.398  0.00  0.00    +0.074 A 
ATOM     13  C   LIG    1       -4.923   1.797  -2.030  0.00  0.00    +0.077 A 
ATOM     14  O   LIG    1       -1.544   2.739  -1.988  0.00  0.00    -0.471 OA
ATOM     15  C   LIG    1       -0.303   2.680  -1.261  0.00  0.00    +0.258 C 
ATOM     16  C   LIG    1        0.596   1.672  -1.921  0.00  0.00    +0.011 C 
ATOM     17  C   LIG    1        1.522   0.897  -1.323  0.00  0.00    -0.006 C 
ATOM     18  C   LIG    1        1.844   0.902   0.141  0.00  0.00    +0.152 C 
ATOM     19  N   LIG    1        2.723  -0.181   0.581  0.00  0.00    -0.308 N 
ATOM     20  C   LIG    1        2.343  -1.273   1.338  0.00  0.00    +0.203 A 
ATOM     21  N   LIG    1        3.355  -1.757   2.020  0.00  0.00    -0.214 NA
ATOM     22  C   LIG    1        4.458  -1.083   1.557  0.00  0.00    +0.091 A 
ATOM     23  C   LIG    1        5.810  -1.252   1.892  0.00  0.00    +0.030 A 
ATOM     24  C   LIG    1        6.763  -0.418   1.294  0.00  0.00    +0.002 A 
ATOM     25  C   LIG    1        6.378   0.570   0.387  0.00  0.00    +0.002 A 
ATOM     26  C   LIG    1        5.034   0.759   0.045  0.00  0.00    +0.028 A 
ATOM     27  C   LIG    1        4.099  -0.094   0.645  0.00  0.00    +0.070 A 
ATOM     28  C   LIG    1       -5.063   1.098  -0.732  0.00  0.00    +0.268 A 
ATOM     29  O   LIG    1       -6.131   0.554  -0.466  0.00  0.00    -0.266 OA
ATOM     30  C   LIG    1       -1.810  -3.291   0.219  0.00  0.00    +0.013 A 
ATOM     31  N   LIG    1        1.051  -1.715   1.474  0.00  0.00    -0.252 N 
ATOM     32  H   LIG    1        0.892  -2.337   2.257  0.00  0.00    +0.158 HD
ENDROOT
TORSDOF 0