REMARK  Name = BDB024834
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.220  -2.787   1.671  0.00  0.00    +0.407 C 
ATOM      2  N   LIG    1        3.613  -2.028   0.654  0.00  0.00    -0.234 N 
ATOM      3  C   LIG    1        4.293  -1.864  -0.655  0.00  0.00    +0.082 C 
ATOM      4  C   LIG    1        4.302  -3.184  -1.448  0.00  0.00    +0.028 C 
ATOM      5  C   LIG    1        3.688  -0.788  -1.571  0.00  0.00    +0.027 C 
ATOM      6  C   LIG    1        3.259   0.419  -0.769  0.00  0.00    +0.041 C 
ATOM      7  C   LIG    1        2.227  -0.042   0.217  0.00  0.00    +0.002 A 
ATOM      8  C   LIG    1        1.076   0.722   0.500  0.00  0.00    +0.094 A 
ATOM      9  N   LIG    1        0.668   1.915  -0.044  0.00  0.00    -0.232 NA
ATOM     10  C   LIG    1       -0.475   2.219   0.536  0.00  0.00    +0.113 A 
ATOM     11  N   LIG    1       -0.824   1.245   1.447  0.00  0.00    -0.319 N 
ATOM     12  C   LIG    1        0.158   0.279   1.444  0.00  0.00    +0.070 A 
ATOM     13  C   LIG    1        0.320  -0.919   2.140  0.00  0.00    +0.030 A 
ATOM     14  C   LIG    1        1.470  -1.667   1.857  0.00  0.00    +0.026 A 
ATOM     15  C   LIG    1        2.429  -1.253   0.919  0.00  0.00    +0.045 A 
ATOM     16  O   LIG    1        3.786  -2.960   2.805  0.00  0.00    -0.226 OA
ENDROOT
BRANCH   1  18
ATOM     17  C   LIG    1        6.098  -4.066   2.288  0.00  0.00    +0.282 C 
ATOM     18  O   LIG    1        5.424  -3.307   1.282  0.00  0.00    -0.453 OA
ENDBRANCH   1  18
BRANCH  11  19
ATOM     19  C   LIG    1       -2.037   1.212   2.246  0.00  0.00    +0.219 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -3.247   0.684   1.496  0.00  0.00    +0.233 C 
ATOM     21  N   LIG    1       -3.027  -0.363   0.623  0.00  0.00    -0.313 N 
ATOM     22  H   LIG    1       -2.078  -0.540   0.315  0.00  0.00    +0.149 HD
ATOM     23  O   LIG    1       -4.371   1.129   1.721  0.00  0.00    -0.274 OA
BRANCH  21  24
ATOM     24  C   LIG    1       -4.108  -0.879  -0.197  0.00  0.00    +0.115 C 
BRANCH  24  25
ATOM     25  C   LIG    1       -3.684  -2.224  -0.766  0.00  0.00    +0.030 C 
ATOM     26  C   LIG    1       -2.634  -2.178  -1.895  0.00  0.00    +0.170 C 
ATOM     27  O   LIG    1       -3.507  -2.913  -2.786  0.00  0.00    -0.378 OA
ATOM     28  C   LIG    1       -4.623  -2.718  -1.885  0.00  0.00    +0.170 C 
ATOM     29  C   LIG    1       -3.421  -3.292   0.295  0.00  0.00    +0.017 C 
ENDBRANCH  24  25
ENDBRANCH  21  24
ENDBRANCH  19  20
ENDBRANCH  11  19
BRANCH  10  30
ATOM     30  C   LIG    1       -1.297   3.438   0.260  0.00  0.00    +0.097 C 
BRANCH  30  31
ATOM     31  C   LIG    1       -0.754   4.229  -0.926  0.00  0.00    +0.151 C 
BRANCH  31  32
ATOM     32  N   LIG    1       -1.517   5.442  -1.151  0.00  0.00    -0.271 N 
ATOM     33  N   LIG    1       -2.788   5.361  -1.591  0.00  0.00    -0.180 NA
ATOM     34  C   LIG    1       -3.173   6.637  -1.680  0.00  0.00    +0.134 A 
ATOM     35  C   LIG    1       -2.158   7.531  -1.294  0.00  0.00    +0.041 A 
ATOM     36  C   LIG    1       -1.096   6.726  -0.955  0.00  0.00    +0.108 A 
ENDBRANCH  31  32
ENDBRANCH  30  31
ENDBRANCH  10  30
TORSDOF 8