REMARK  Name = BDB049356
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -3.426  -1.803  -0.131  0.00  0.00    -0.011 A 
ATOM      2  C   LIG    1       -2.156  -2.348  -0.371  0.00  0.00    +0.038 A 
ATOM      3  C   LIG    1       -1.020  -1.610  -0.007  0.00  0.00    +0.090 A 
ATOM      4  N   LIG    1        0.303  -1.935  -0.142  0.00  0.00    -0.232 NA
ATOM      5  C   LIG    1        0.982  -0.915   0.343  0.00  0.00    +0.111 A 
ATOM      6  N   LIG    1        0.123   0.067   0.800  0.00  0.00    -0.326 N 
ATOM      7  C   LIG    1       -1.168  -0.359   0.583  0.00  0.00    +0.069 A 
ATOM      8  C   LIG    1       -2.422   0.209   0.830  0.00  0.00    +0.028 A 
ATOM      9  C   LIG    1       -3.548  -0.539   0.460  0.00  0.00    +0.011 A 
ENDROOT
BRANCH   1  12
ATOM     10  C   LIG    1       -5.894  -0.954  -2.143  0.00  0.00    +0.070 C 
ATOM     11  C   LIG    1       -5.697  -2.194  -1.356  0.00  0.00    +0.088 A 
ATOM     12  C   LIG    1       -4.615  -2.540  -0.503  0.00  0.00    +0.047 A 
ATOM     13  C   LIG    1       -4.943  -3.797  -0.043  0.00  0.00    +0.142 A 
ATOM     14  C   LIG    1       -4.313  -4.766   0.874  0.00  0.00    +0.090 C 
ATOM     15  O   LIG    1       -6.132  -4.175  -0.586  0.00  0.00    -0.359 OA
ATOM     16  N   LIG    1       -6.611  -3.171  -1.405  0.00  0.00    -0.083 NA
ENDBRANCH   1  12
BRANCH   6  17
ATOM     17  C   LIG    1        0.514   1.314   1.437  0.00  0.00    +0.139 C 
BRANCH  17  18
ATOM     18  C   LIG    1        0.720   2.468   0.439  0.00  0.00    +0.106 C 
BRANCH  18  19
ATOM     19  N   LIG    1       -0.515   3.187   0.079  0.00  0.00    -0.296 NA
ATOM     20  C   LIG    1       -1.034   4.000   1.206  0.00  0.00    +0.112 C 
ATOM     21  C   LIG    1       -1.888   5.183   0.724  0.00  0.00    +0.175 C 
ATOM     22  O   LIG    1       -1.129   6.123  -0.048  0.00  0.00    -0.377 OA
ATOM     23  C   LIG    1       -0.073   5.513  -0.802  0.00  0.00    +0.175 C 
ATOM     24  C   LIG    1       -0.335   4.033  -1.124  0.00  0.00    +0.112 C 
ENDBRANCH  18  19
ENDBRANCH  17  18
ENDBRANCH   6  17
BRANCH   5  25
ATOM     25  C   LIG    1        2.474  -0.814   0.411  0.00  0.00    +0.079 C 
BRANCH  25  26
ATOM     26  C   LIG    1        3.170  -1.938  -0.361  0.00  0.00    +0.043 C 
BRANCH  26  27
ATOM     27  C   LIG    1        4.674  -1.798  -0.303  0.00  0.00    -0.047 A 
ATOM     28  C   LIG    1        5.358  -1.084  -1.296  0.00  0.00    +0.005 A 
ATOM     29  C   LIG    1        6.746  -0.938  -1.232  0.00  0.00    +0.019 A 
ATOM     30  C   LIG    1        7.463  -1.501  -0.172  0.00  0.00    +0.052 A 
ATOM     31  C   LIG    1        6.785  -2.211   0.823  0.00  0.00    +0.019 A 
ATOM     32  C   LIG    1        5.397  -2.357   0.758  0.00  0.00    +0.005 A 
BRANCH  30  33
ATOM     33  C   LIG    1        8.886  -1.348  -0.105  0.00  0.00    +0.099 C 
ATOM     34  N   LIG    1       10.039  -1.219  -0.048  0.00  0.00    -0.191 NA
ENDBRANCH  30  33
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH   5  25
TORSDOF 8