REMARK  Name = BDB063493
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.328  -1.194   0.565  0.00  0.00    +0.122 A 
ATOM      2  C   LIG    1       -0.061  -0.624   0.381  0.00  0.00    +0.056 A 
ATOM      3  C   LIG    1        1.093  -1.417   0.436  0.00  0.00    +0.014 A 
ATOM      4  C   LIG    1        0.969  -2.782   0.673  0.00  0.00    +0.050 A 
ATOM      5  C   LIG    1        2.179  -3.616   0.727  0.00  0.00    +0.272 A 
ATOM      6  N   LIG    1        3.368  -2.961   0.534  0.00  0.00    -0.242 N 
ATOM      7  H   LIG    1        4.220  -3.513   0.568  0.00  0.00    +0.192 HD
ATOM      8  N   LIG    1        3.522  -1.631   0.303  0.00  0.00    -0.175 NA
ATOM      9  O   LIG    1        2.111  -4.822   0.932  0.00  0.00    -0.266 OA
ATOM     10  C   LIG    1       -0.293  -3.359   0.858  0.00  0.00    +0.017 A 
ATOM     11  C   LIG    1        2.465  -0.874   0.251  0.00  0.00    +0.074 A 
ATOM     12  C   LIG    1       -1.441  -2.564   0.803  0.00  0.00    +0.046 A 
ENDROOT
BRANCH   1  13
ATOM     13  O   LIG    1       -2.363  -0.305   0.482  0.00  0.00    -0.486 OA
BRANCH  13  14
ATOM     14  C   LIG    1       -3.674  -0.806   0.725  0.00  0.00    +0.284 C 
BRANCH  14  20
ATOM     15  C   LIG    1       -4.365   0.734  -1.877  0.00  0.00    +0.152 C 
ATOM     16  N   LIG    1       -4.896   1.029  -0.564  0.00  0.00    -0.309 N 
ATOM     17  C   LIG    1       -5.769   2.036  -0.228  0.00  0.00    +0.291 A 
ATOM     18  N   LIG    1       -6.027   2.058   1.066  0.00  0.00    -0.215 NA
ATOM     19  C   LIG    1       -5.296   1.029   1.591  0.00  0.00    +0.139 A 
ATOM     20  C   LIG    1       -4.588   0.363   0.610  0.00  0.00    +0.077 A 
BRANCH  17  21
ATOM     21  N   LIG    1       -6.352   2.972  -1.157  0.00  0.00    +0.093 N 
ATOM     22  O   LIG    1       -6.275   2.703  -2.364  0.00  0.00    -0.123 OA
ATOM     23  O   LIG    1       -6.890   3.982  -0.685  0.00  0.00    -0.123 OA
ENDBRANCH  17  21
ENDBRANCH  14  20
ENDBRANCH  13  14
ENDBRANCH   1  13
BRANCH  11  24
ATOM     24  C   LIG    1        2.619   0.622  -0.006  0.00  0.00    +0.093 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.036   1.113  -0.183  0.00  0.00    -0.042 A 
ATOM     26  C   LIG    1        4.631   1.129  -1.452  0.00  0.00    +0.004 A 
ATOM     27  C   LIG    1        5.942   1.580  -1.613  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1        6.672   2.013  -0.508  0.00  0.00    +0.000 A 
ATOM     29  C   LIG    1        6.095   1.991   0.759  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        4.784   1.540   0.923  0.00  0.00    +0.004 A 
ENDBRANCH  24  25
ENDBRANCH  11  24
TORSDOF 6