REMARK  Name = BDB009192
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.336   0.061   1.370  0.00  0.00    +0.037 A 
ATOM      2  C   LIG    1       -0.725   0.962   1.202  0.00  0.00    +0.017 A 
ATOM      3  C   LIG    1       -1.730   1.069   2.175  0.00  0.00    -0.041 A 
ATOM      4  C   LIG    1       -1.640   0.278   3.330  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -0.594  -0.633   3.491  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        0.390  -0.750   2.509  0.00  0.00    +0.013 A 
ENDROOT
BRANCH   1   9
ATOM      7  N   LIG    1        2.663  -0.191   0.766  0.00  0.00    -0.282 N 
ATOM      8  H   LIG    1        2.797  -0.168   1.768  0.00  0.00    +0.155 HD
ATOM      9  C   LIG    1        1.371  -0.024   0.302  0.00  0.00    +0.248 C 
ATOM     10  O   LIG    1        1.009   0.080  -0.863  0.00  0.00    -0.270 OA
BRANCH   7  14
ATOM     11  C   LIG    1        6.294  -0.545  -1.380  0.00  0.00    -0.048 A 
ATOM     12  C   LIG    1        5.086  -0.432  -2.078  0.00  0.00    +0.005 A 
ATOM     13  C   LIG    1        3.870  -0.318  -1.394  0.00  0.00    +0.023 A 
ATOM     14  C   LIG    1        3.841  -0.311   0.000  0.00  0.00    +0.034 A 
ATOM     15  C   LIG    1        5.048  -0.432   0.700  0.00  0.00    +0.023 A 
ATOM     16  C   LIG    1        6.263  -0.552   0.018  0.00  0.00    +0.005 A 
BRANCH  11  18
ATOM     17  C   LIG    1        7.827  -2.079  -2.652  0.00  0.00    +0.009 C 
ATOM     18  C   LIG    1        7.600  -0.671  -2.121  0.00  0.00    +0.032 C 
ENDBRANCH  11  18
ENDBRANCH   7  14
ENDBRANCH   1   9
BRANCH   3  19
ATOM     19  C   LIG    1       -2.867   2.055   2.022  0.00  0.00    +0.092 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -3.499   2.074   0.633  0.00  0.00    +0.069 A 
ATOM     21  C   LIG    1       -4.317   0.908   0.172  0.00  0.00    -0.016 A 
ATOM     22  C   LIG    1       -4.569  -0.268   1.073  0.00  0.00    +0.037 C 
ATOM     23  C   LIG    1       -5.694  -1.182   0.576  0.00  0.00    +0.005 C 
ATOM     24  C   LIG    1       -5.572  -1.434  -0.922  0.00  0.00    +0.005 C 
ATOM     25  C   LIG    1       -5.628  -0.121  -1.706  0.00  0.00    +0.041 C 
ATOM     26  C   LIG    1       -4.815   0.977  -1.076  0.00  0.00    +0.023 A 
ATOM     27  C   LIG    1       -4.569   2.178  -1.911  0.00  0.00    +0.268 A 
ATOM     28  O   LIG    1       -5.025   2.282  -3.045  0.00  0.00    -0.266 OA
ATOM     29  N   LIG    1       -3.818   3.165  -1.333  0.00  0.00    -0.243 N 
ATOM     30  H   LIG    1       -3.629   3.990  -1.892  0.00  0.00    +0.192 HD
ATOM     31  N   LIG    1       -3.277   3.133  -0.087  0.00  0.00    -0.175 NA
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 5