REMARK  Name = BDB015177
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -1.075  -2.322  -0.131  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.818  -1.351  -0.742  0.00  0.00    +0.121 A 
ATOM      3  C   LIG    1       -3.171  -1.350  -0.385  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1       -4.074  -0.411  -0.913  0.00  0.00    -0.014 A 
ATOM      5  C   LIG    1       -3.579   0.539  -1.818  0.00  0.00    +0.009 A 
ATOM      6  C   LIG    1       -2.230   0.548  -2.177  0.00  0.00    +0.004 A 
ATOM      7  C   LIG    1       -1.350  -0.394  -1.640  0.00  0.00    +0.045 A 
BRANCH   4   8
ATOM      8  C   LIG    1       -5.495  -0.425  -0.528  0.00  0.00    -0.016 A 
ATOM      9  C   LIG    1       -6.094   0.728   0.018  0.00  0.00    +0.036 A 
ATOM     10  C   LIG    1       -7.449   0.663   0.371  0.00  0.00    +0.069 A 
ATOM     11  C   LIG    1       -8.218  -0.484   0.201  0.00  0.00    +0.089 A 
ATOM     12  N   LIG    1       -9.509  -0.281   0.623  0.00  0.00    -0.236 NA
ATOM     13  C   LIG    1       -9.540   0.961   1.049  0.00  0.00    +0.200 A 
ATOM     14  C   LIG    1       -7.626  -1.631  -0.343  0.00  0.00    +0.030 A 
ATOM     15  N   LIG    1       -8.324   1.569   0.918  0.00  0.00    -0.333 N 
ATOM     16  C   LIG    1       -8.018   2.925   1.293  0.00  0.00    +0.150 C 
ATOM     17  C   LIG    1       -6.270  -1.586  -0.700  0.00  0.00    +0.011 A 
ENDBRANCH   4   8
ENDBRANCH   1   2
BRANCH   1  18
ATOM     18  C   LIG    1        0.293  -2.494  -0.523  0.00  0.00    +0.261 C 
BRANCH  18  19
ATOM     19  C   LIG    1        1.207  -1.584   0.314  0.00  0.00    +0.166 C 
BRANCH  19  20
ATOM     20  O   LIG    1        1.039  -1.939   1.697  0.00  0.00    -0.387 OA
ATOM     21  H   LIG    1        0.077  -1.909   1.862  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1        2.684  -1.765  -0.102  0.00  0.00    +0.119 C 
BRANCH  22  28
ATOM     23  C   LIG    1        9.365   1.333  -1.215  0.00  0.00    +0.044 C 
ATOM     24  C   LIG    1        8.095   1.246  -0.422  0.00  0.00    -0.050 A 
ATOM     25  C   LIG    1        7.112   0.306  -0.758  0.00  0.00    +0.008 A 
ATOM     26  C   LIG    1        5.929   0.198  -0.009  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        4.903  -0.854  -0.371  0.00  0.00    +0.120 C 
ATOM     28  N   LIG    1        3.559  -0.609   0.197  0.00  0.00    -0.295 NA
ATOM     29  C   LIG    1        3.683  -0.356   1.643  0.00  0.00    +0.089 C 
ATOM     30  C   LIG    1        4.474   0.935   1.909  0.00  0.00    +0.051 C 
ATOM     31  C   LIG    1        5.750   1.020   1.114  0.00  0.00    -0.042 A 
ATOM     32  C   LIG    1        6.733   1.957   1.454  0.00  0.00    +0.004 A 
ATOM     33  C   LIG    1        7.900   2.063   0.696  0.00  0.00    +0.003 A 
ENDBRANCH  22  28
ENDBRANCH  19  22
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 7