REMARK  Name = BDB020602
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.565  -2.535   0.285  0.00  0.00    +0.043 A 
ATOM      2  C   LIG    1       -0.139  -1.458   1.000  0.00  0.00    -0.016 A 
ATOM      3  C   LIG    1        0.709  -0.287   1.433  0.00  0.00    +0.046 C 
ATOM      4  C   LIG    1       -1.478  -1.588   1.228  0.00  0.00    +0.056 A 
ATOM      5  N   LIG    1       -2.111  -2.791   0.806  0.00  0.00    -0.317 N 
ATOM      6  C   LIG    1       -1.430  -3.839   0.182  0.00  0.00    +0.047 A 
ATOM      7  C   LIG    1       -2.310  -4.870  -0.065  0.00  0.00    +0.027 A 
ATOM      8  C   LIG    1       -3.576  -4.460   0.395  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1       -3.432  -3.191   0.910  0.00  0.00    +0.091 A 
ATOM     10  C   LIG    1       -0.049  -3.671  -0.092  0.00  0.00    +0.039 A 
ENDROOT
BRANCH   1  13
ATOM     11  N   LIG    1        2.072  -1.968  -1.466  0.00  0.00    -0.307 N 
ATOM     12  H   LIG    1        1.210  -1.720  -1.944  0.00  0.00    +0.149 HD
ATOM     13  C   LIG    1        1.980  -2.388  -0.161  0.00  0.00    +0.245 C 
ATOM     14  O   LIG    1        2.927  -2.555   0.596  0.00  0.00    -0.270 OA
BRANCH  11  15
ATOM     15  C   LIG    1        3.258  -1.301  -1.959  0.00  0.00    +0.145 C 
BRANCH  15  22
ATOM     16  C   LIG    1        2.235   4.275  -0.666  0.00  0.00    +0.063 C 
ATOM     17  C   LIG    1        2.610   2.858  -0.968  0.00  0.00    +0.016 A 
ATOM     18  N   LIG    1        1.779   2.160  -1.807  0.00  0.00    -0.326 N 
ATOM     19  H   LIG    1        0.914   2.587  -2.141  0.00  0.00    +0.169 HD
ATOM     20  C   LIG    1        1.994   0.869  -2.213  0.00  0.00    +0.254 A 
ATOM     21  O   LIG    1        1.246   0.301  -3.006  0.00  0.00    -0.268 OA
ATOM     22  C   LIG    1        3.168   0.157  -1.599  0.00  0.00    +0.037 A 
ATOM     23  C   LIG    1        3.980   0.851  -0.770  0.00  0.00    -0.039 A 
ATOM     24  C   LIG    1        5.175   0.293  -0.047  0.00  0.00    +0.044 C 
ATOM     25  C   LIG    1        3.697   2.249  -0.474  0.00  0.00    +0.024 A 
ENDBRANCH  15  22
ENDBRANCH  11  15
ENDBRANCH   1  13
BRANCH   4  26
ATOM     26  C   LIG    1       -2.304  -0.496   1.896  0.00  0.00    +0.163 C 
ATOM     27  C   LIG    1       -2.718  -0.857   3.322  0.00  0.00    +0.044 C 
BRANCH  26  28
ATOM     28  O   LIG    1       -3.475  -0.209   1.120  0.00  0.00    -0.365 OA
BRANCH  28  29
ATOM     29  C   LIG    1       -3.625   1.166   0.772  0.00  0.00    +0.215 C 
BRANCH  29  30
ATOM     30  C   LIG    1       -2.757   1.456  -0.400  0.00  0.00    +0.064 A 
ATOM     31  N   LIG    1       -1.988   2.585  -0.531  0.00  0.00    -0.269 N 
ATOM     32  C   LIG    1       -1.867   3.680   0.404  0.00  0.00    +0.172 C 
ATOM     33  N   LIG    1       -1.279   2.624  -1.679  0.00  0.00    -0.180 NA
ATOM     34  C   LIG    1       -1.641   1.502  -2.308  0.00  0.00    +0.134 A 
ATOM     35  C   LIG    1       -2.547   0.737  -1.559  0.00  0.00    +0.046 A 
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  26  28
ENDBRANCH   4  26
TORSDOF 7