REMARK  Name = BDB010292
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.753  -1.003   0.154  0.00  0.00    +0.201 A 
ATOM      2  N   LIG    1        0.528  -0.475  -0.218  0.00  0.00    -0.307 N 
ATOM      3  C   LIG    1       -0.431  -1.014   0.614  0.00  0.00    +0.129 A 
ATOM      4  C   LIG    1        0.305  -1.740   1.536  0.00  0.00    +0.185 A 
ATOM      5  N   LIG    1       -0.223  -2.384   2.586  0.00  0.00    -0.200 NA
ATOM      6  C   LIG    1       -1.552  -2.235   2.660  0.00  0.00    +0.242 A 
ATOM      7  N   LIG    1       -2.349  -1.555   1.803  0.00  0.00    -0.205 NA
ATOM      8  C   LIG    1       -1.816  -0.935   0.735  0.00  0.00    +0.149 A 
ATOM      9  N   LIG    1        1.635  -1.720   1.246  0.00  0.00    -0.194 NA
ENDROOT
BRANCH   1  14
ATOM     10  C   LIG    1        4.866  -2.586   1.791  0.00  0.00    +0.009 C 
ATOM     11  C   LIG    1        4.901  -1.984   0.384  0.00  0.00    +0.006 C 
ATOM     12  C   LIG    1        4.131  -0.638   0.310  0.00  0.00    +0.076 C 
ATOM     13  C   LIG    1        5.021   0.487  -0.238  0.00  0.00    +0.028 C 
ATOM     14  N   LIG    1        2.905  -0.712  -0.517  0.00  0.00    -0.298 N 
ATOM     15  C   LIG    1        3.044  -1.290  -1.867  0.00  0.00    +0.108 C 
ATOM     16  C   LIG    1        4.148  -2.340  -1.973  0.00  0.00    +0.019 C 
ATOM     17  C   LIG    1        4.414  -3.017  -0.640  0.00  0.00    +0.006 C 
ENDBRANCH   1  14
BRANCH   6  18
ATOM     18  C   LIG    1       -2.263  -2.902   3.808  0.00  0.00    +0.375 C 
ATOM     19  O   LIG    1       -3.465  -2.899   4.025  0.00  0.00    -0.242 OA
BRANCH  18  20
ATOM     20  O   LIG    1       -1.432  -3.558   4.651  0.00  0.00    -0.475 OA
ATOM     21  H   LIG    1       -2.028  -3.930   5.332  0.00  0.00    +0.296 HD
ENDBRANCH  18  20
ENDBRANCH   6  18
BRANCH   8  22
ATOM     22  N   LIG    1       -2.616  -0.262  -0.174  0.00  0.00    -0.324 N 
ATOM     23  H   LIG    1       -2.285  -0.383  -1.123  0.00  0.00    +0.148 HD
BRANCH  22  24
ATOM     24  C   LIG    1       -4.083  -0.286  -0.092  0.00  0.00    +0.072 C 
ATOM     25  C   LIG    1       -4.590   0.448   1.150  0.00  0.00    +0.028 C 
BRANCH  24  26
ATOM     26  C   LIG    1       -4.692  -1.693  -0.201  0.00  0.00    +0.009 C 
ATOM     27  C   LIG    1       -4.370  -2.500  -1.491  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -5.694  -1.987  -2.084  0.00  0.00    +0.001 C 
ATOM     29  C   LIG    1       -6.183  -1.761  -0.642  0.00  0.00    +0.005 C 
ENDBRANCH  24  26
ENDBRANCH  22  24
ENDBRANCH   8  22
BRANCH   2  30
ATOM     30  C   LIG    1        0.319   0.571  -1.203  0.00  0.00    +0.128 C 
BRANCH  30  31
ATOM     31  C   LIG    1        0.019   1.954  -0.595  0.00  0.00    +0.009 C 
ATOM     32  C   LIG    1       -0.463   2.911  -1.697  0.00  0.00    +0.005 C 
ATOM     33  C   LIG    1       -0.736   4.312  -1.154  0.00  0.00    +0.003 C 
ATOM     34  C   LIG    1        0.491   4.892  -0.442  0.00  0.00    -0.014 C 
ATOM     35  C   LIG    1        0.180   6.272   0.133  0.00  0.00    +0.007 C 
ATOM     36  C   LIG    1        0.976   3.943   0.660  0.00  0.00    +0.003 C 
ATOM     37  C   LIG    1        1.247   2.539   0.121  0.00  0.00    +0.005 C 
ENDBRANCH  30  31
ENDBRANCH   2  30
TORSDOF 8