REMARK  Name = BDB018732
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.891  -0.169  -0.887  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1       -1.758  -0.280   0.214  0.00  0.00    +0.032 A 
ATOM      3  C   LIG    1       -3.007   0.341   0.199  0.00  0.00    +0.037 A 
ATOM      4  N   LIG    1       -3.852   0.227   1.307  0.00  0.00    -0.285 N 
ATOM      5  H   LIG    1       -3.495  -0.156   2.175  0.00  0.00    +0.155 HD
ATOM      6  C   LIG    1       -5.138   0.701   1.345  0.00  0.00    +0.225 C 
ATOM      7  C   LIG    1       -5.760   1.083   0.000  0.00  0.00    +0.069 C 
ATOM      8  C   LIG    1       -6.248  -0.195  -0.709  0.00  0.00    +0.132 C 
ATOM      9  N   LIG    1       -7.731  -0.242  -0.519  0.00  0.00    -0.268 N 
ATOM     10  C   LIG    1       -8.124   0.863   0.387  0.00  0.00    +0.117 C 
ATOM     11  C   LIG    1       -4.723   1.845  -0.833  0.00  0.00    +0.054 C 
ATOM     12  C   LIG    1       -7.039   1.907   0.177  0.00  0.00    +0.037 C 
ATOM     13  O   LIG    1       -5.756   0.727   2.407  0.00  0.00    -0.275 OA
ATOM     14  C   LIG    1       -3.414   1.104  -0.898  0.00  0.00    -0.025 A 
ATOM     15  C   LIG    1       -2.558   1.234  -1.993  0.00  0.00    +0.006 A 
ATOM     16  C   LIG    1       -1.314   0.595  -1.989  0.00  0.00    +0.009 A 
ENDROOT
BRANCH   1  19
ATOM     17  C   LIG    1        2.573  -1.273   0.171  0.00  0.00    +0.037 A 
ATOM     18  C   LIG    1        1.326  -0.639   0.174  0.00  0.00    +0.021 A 
ATOM     19  C   LIG    1        0.424  -0.831  -0.884  0.00  0.00    -0.017 A 
ATOM     20  C   LIG    1        0.808  -1.685  -1.934  0.00  0.00    +0.008 A 
ATOM     21  C   LIG    1        2.046  -2.338  -1.924  0.00  0.00    +0.001 A 
ATOM     22  C   LIG    1        2.928  -2.139  -0.866  0.00  0.00    +0.013 A 
BRANCH  17  28
ATOM     23  C   LIG    1        8.898   0.245   0.435  0.00  0.00    +0.105 C 
ATOM     24  N   LIG    1        7.579  -0.318   0.695  0.00  0.00    -0.302 NA
ATOM     25  C   LIG    1        6.997   0.196   1.942  0.00  0.00    +0.103 C 
ATOM     26  C   LIG    1        5.646  -0.478   2.256  0.00  0.00    +0.123 C 
ATOM     27  N   LIG    1        4.755  -0.579   1.099  0.00  0.00    -0.295 N 
ATOM     28  C   LIG    1        3.476  -1.074   1.322  0.00  0.00    +0.247 C 
ATOM     29  O   LIG    1        3.047  -1.369   2.436  0.00  0.00    -0.270 OA
ATOM     30  C   LIG    1        5.191   0.140  -0.098  0.00  0.00    +0.123 C 
ATOM     31  C   LIG    1        6.668  -0.143  -0.453  0.00  0.00    +0.103 C 
ENDBRANCH  17  28
ENDBRANCH   1  19
BRANCH   9  32
ATOM     32  C   LIG    1       -8.468  -1.345  -0.709  0.00  0.00    +0.169 C 
ATOM     33  N   LIG    1       -9.099  -2.301  -0.876  0.00  0.00    -0.174 NA
ENDBRANCH   9  32
TORSDOF 3