REMARK  Name = BDB057342
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.708   0.861   0.425  0.00  0.00    +0.098 A 
ATOM      2  C   LIG    1       -2.558   0.113   0.032  0.00  0.00    +0.022 A 
ATOM      3  C   LIG    1       -3.021  -1.006  -0.662  0.00  0.00    +0.049 A 
ATOM      4  C   LIG    1       -2.163  -1.969  -1.200  0.00  0.00    +0.030 A 
ATOM      5  C   LIG    1       -0.789  -1.778  -1.018  0.00  0.00    +0.048 A 
ATOM      6  C   LIG    1       -0.285  -0.672  -0.331  0.00  0.00    +0.122 A 
ATOM      7  N   LIG    1       -4.396  -0.931  -0.684  0.00  0.00    -0.342 N 
ATOM      8  H   LIG    1       -4.999  -1.604  -1.131  0.00  0.00    +0.167 HD
ATOM      9  C   LIG    1       -1.163   0.280   0.199  0.00  0.00    +0.057 A 
ATOM     10  C   LIG    1       -4.827   0.190  -0.025  0.00  0.00    +0.112 A 
ENDROOT
BRANCH  10  11
ATOM     11  N   LIG    1       -6.145   0.449   0.066  0.00  0.00    -0.344 N 
ATOM     12  H   LIG    1       -6.494   1.210   0.650  0.00  0.00    +0.144 HD
ATOM     13  H   LIG    1       -6.866  -0.226  -0.174  0.00  0.00    +0.144 HD
ENDBRANCH  10  11
BRANCH   1  15
ATOM     14  N   LIG    1       -3.707   3.078   1.763  0.00  0.00    -0.191 NA
ATOM     15  C   LIG    1       -3.712   2.086   1.160  0.00  0.00    +0.103 C 
ENDBRANCH   1  15
BRANCH   6  16
ATOM     16  O   LIG    1        1.081  -0.638  -0.245  0.00  0.00    -0.487 OA
BRANCH  16  17
ATOM     17  C   LIG    1        1.665   0.467   0.445  0.00  0.00    +0.264 C 
BRANCH  17  18
ATOM     18  C   LIG    1        3.168   0.334   0.395  0.00  0.00    -0.010 A 
ATOM     19  C   LIG    1        3.928   0.339   1.573  0.00  0.00    +0.007 A 
ATOM     20  C   LIG    1        5.320   0.237   1.519  0.00  0.00    +0.000 A 
ATOM     21  C   LIG    1        5.966   0.134   0.288  0.00  0.00    +0.000 A 
ATOM     22  C   LIG    1        5.222   0.132  -0.890  0.00  0.00    +0.000 A 
ATOM     23  C   LIG    1        3.831   0.234  -0.838  0.00  0.00    +0.007 A 
ENDBRANCH  17  18
ENDBRANCH  16  17
ENDBRANCH   6  16
TORSDOF 5