REMARK  Name = BDB007978
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.769  -0.692  -1.355  0.00  0.00    +0.180 C 
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1        2.925  -0.742  -1.701  0.00  0.00    +0.063 C 
ATOM      3  C   LIG    1        1.969  -1.744  -2.366  0.00  0.00    +0.027 C 
ATOM      4  C   LIG    1        0.988  -2.390  -1.383  0.00  0.00    +0.085 C 
ATOM      5  N   LIG    1        0.243  -1.427  -0.558  0.00  0.00    -0.294 NA
ATOM      6  C   LIG    1        1.180  -0.536   0.146  0.00  0.00    +0.085 C 
ATOM      7  C   LIG    1        2.164   0.203  -0.765  0.00  0.00    +0.027 C 
BRANCH   2   8
ATOM      8  C   LIG    1        4.067  -1.447  -0.963  0.00  0.00    +0.166 C 
ATOM      9  O   LIG    1        3.972  -2.618  -0.598  0.00  0.00    -0.292 OA
BRANCH   8  13
ATOM     10  C   LIG    1        7.766   0.583  -0.032  0.00  0.00    +0.120 A 
ATOM     11  C   LIG    1        7.523  -0.721   0.399  0.00  0.00    +0.046 A 
ATOM     12  C   LIG    1        6.321  -1.363   0.088  0.00  0.00    +0.015 A 
ATOM     13  C   LIG    1        5.337  -0.707  -0.662  0.00  0.00    +0.018 A 
ATOM     14  C   LIG    1        5.583   0.601  -1.096  0.00  0.00    +0.015 A 
ATOM     15  C   LIG    1        6.791   1.242  -0.781  0.00  0.00    +0.046 A 
BRANCH  10  17
ATOM     16  C   LIG    1        9.278   2.418  -0.079  0.00  0.00    +0.277 C 
ATOM     17  O   LIG    1        8.977   1.093   0.340  0.00  0.00    -0.495 OA
ENDBRANCH  10  17
ENDBRANCH   8  13
ENDBRANCH   2   8
ENDBRANCH   1   5
BRANCH   1  18
ATOM     18  C   LIG    1       -1.808  -0.046  -0.431  0.00  0.00    +0.227 C 
ATOM     19  N   LIG    1       -2.141  -0.837   0.655  0.00  0.00    -0.307 N 
ATOM     20  H   LIG    1       -1.407  -1.513   0.865  0.00  0.00    +0.149 HD
ATOM     21  O   LIG    1       -2.330   1.038  -0.668  0.00  0.00    -0.274 OA
BRANCH  19  22
ATOM     22  C   LIG    1       -2.876  -0.269   1.771  0.00  0.00    +0.178 C 
BRANCH  22  23
ATOM     23  C   LIG    1       -4.358  -0.094   1.466  0.00  0.00    +0.127 A 
ATOM     24  N   LIG    1       -4.904  -1.020   0.618  0.00  0.00    -0.309 N 
ATOM     25  H   LIG    1       -4.295  -1.667   0.137  0.00  0.00    +0.170 HD
ATOM     26  C   LIG    1       -6.203  -0.964   0.213  0.00  0.00    +0.257 A 
ATOM     27  O   LIG    1       -6.661  -1.710  -0.645  0.00  0.00    -0.267 OA
ATOM     28  C   LIG    1       -7.013   0.072   0.874  0.00  0.00    +0.064 A 
ATOM     29  C   LIG    1       -8.466   0.152   0.544  0.00  0.00    +0.202 C 
ATOM     30  O   LIG    1       -9.184   1.003   1.454  0.00  0.00    -0.375 OA
ATOM     31  C   LIG    1       -8.501   2.240   1.671  0.00  0.00    +0.166 C 
ATOM     32  C   LIG    1       -7.183   1.991   2.401  0.00  0.00    +0.084 C 
ATOM     33  C   LIG    1       -6.392   0.895   1.734  0.00  0.00    +0.056 A 
ATOM     34  N   LIG    1       -5.053   0.834   2.044  0.00  0.00    -0.237 NA
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH   1  18
TORSDOF 7