REMARK  Name = BDB063206
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.921  -0.447  -1.756  0.00  0.00    +0.117 C 
ENDROOT
BRANCH   1   2
ATOM      2  C   LIG    1       -1.810   0.438  -0.518  0.00  0.00    -0.026 A 
ATOM      3  C   LIG    1       -0.915   0.157   0.527  0.00  0.00    +0.006 A 
ATOM      4  C   LIG    1       -0.835   0.988   1.648  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -1.653   2.115   1.757  0.00  0.00    -0.050 A 
ATOM      6  C   LIG    1       -1.535   3.029   2.940  0.00  0.00    +0.044 C 
ATOM      7  C   LIG    1       -2.535   2.413   0.714  0.00  0.00    +0.004 A 
ATOM      8  C   LIG    1       -2.615   1.582  -0.408  0.00  0.00    +0.006 A 
ENDBRANCH   1   2
BRANCH   1   9
ATOM      9  N   LIG    1       -0.599  -0.819  -2.253  0.00  0.00    -0.307 N 
ATOM     10  H   LIG    1       -0.087  -1.503  -1.703  0.00  0.00    +0.149 HD
ATOM     11  C   LIG    1        0.143   0.036  -3.042  0.00  0.00    +0.218 C 
ATOM     12  O   LIG    1       -0.329   1.013  -3.617  0.00  0.00    -0.275 OA
BRANCH  11  13
ATOM     13  C   LIG    1        1.606  -0.356  -3.177  0.00  0.00    +0.130 C 
BRANCH  13  14
ATOM     14  C   LIG    1        2.321  -0.407  -1.846  0.00  0.00    -0.038 A 
ATOM     15  C   LIG    1        2.410   0.744  -1.049  0.00  0.00    +0.008 A 
ATOM     16  C   LIG    1        3.018   0.706   0.215  0.00  0.00    -0.044 A 
ATOM     17  C   LIG    1        3.091   1.975   1.028  0.00  0.00    +0.035 C 
ATOM     18  C   LIG    1        3.406   1.726   2.502  0.00  0.00    +0.005 C 
ATOM     19  C   LIG    1        4.577   0.762   2.639  0.00  0.00    +0.005 C 
ATOM     20  C   LIG    1        4.224  -0.596   2.035  0.00  0.00    +0.035 C 
ATOM     21  C   LIG    1        3.583  -0.496   0.673  0.00  0.00    -0.044 A 
ATOM     22  C   LIG    1        3.499  -1.644  -0.128  0.00  0.00    +0.004 A 
ATOM     23  C   LIG    1        2.876  -1.601  -1.376  0.00  0.00    +0.004 A 
ENDBRANCH  13  14
ENDBRANCH  11  13
ENDBRANCH   1   9
BRANCH   1  24
ATOM     24  C   LIG    1       -2.828  -1.692  -1.576  0.00  0.00    +0.122 C 
BRANCH  24  26
ATOM     25  C   LIG    1       -5.267  -2.447  -1.655  0.00  0.00    +0.005 C 
ATOM     26  C   LIG    1       -4.306  -1.296  -1.375  0.00  0.00    +0.013 C 
ENDBRANCH  24  26
BRANCH  24  27
ATOM     27  C   LIG    1       -2.265  -2.591  -0.495  0.00  0.00    +0.310 C 
ATOM     28  O   LIG    1       -1.150  -3.097  -0.519  0.00  0.00    -0.251 OA
BRANCH  27  29
ATOM     29  O   LIG    1       -3.071  -2.810   0.555  0.00  0.00    -0.480 OA
ATOM     30  H   LIG    1       -2.546  -3.373   1.161  0.00  0.00    +0.295 HD
ENDBRANCH  27  29
ENDBRANCH  24  27
ENDBRANCH   1  24
TORSDOF 8