REMARK  Name = BDB026669
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        4.086   0.794  -0.482  0.00  0.00    +0.039 A 
ATOM      2  C   LIG    1        3.682  -0.434   0.059  0.00  0.00    +0.043 A 
ATOM      3  C   LIG    1        2.321  -0.634   0.341  0.00  0.00    +0.091 A 
ATOM      4  N   LIG    1        1.718  -1.746   0.852  0.00  0.00    -0.227 NA
ATOM      5  C   LIG    1        0.442  -1.438   0.982  0.00  0.00    +0.149 A 
ATOM      6  N   LIG    1        0.168  -0.186   0.442  0.00  0.00    -0.292 N 
ATOM      7  C   LIG    1        1.394   0.373   0.088  0.00  0.00    +0.074 A 
ATOM      8  C   LIG    1        1.775   1.590  -0.502  0.00  0.00    +0.029 A 
ATOM      9  C   LIG    1        3.136   1.782  -0.771  0.00  0.00    +0.015 A 
ENDROOT
BRANCH   6  10
ATOM     10  C   LIG    1       -1.104   0.394   0.195  0.00  0.00    +0.049 A 
ATOM     11  C   LIG    1       -2.110  -0.376  -0.405  0.00  0.00    +0.031 A 
ATOM     12  C   LIG    1       -3.361   0.193  -0.670  0.00  0.00    -0.024 A 
ATOM     13  C   LIG    1       -4.425  -0.574  -1.405  0.00  0.00    +0.046 C 
ATOM     14  C   LIG    1       -5.815  -0.101  -1.013  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1       -5.931   1.406  -1.039  0.00  0.00    +0.218 C 
ATOM     16  N   LIG    1       -4.832   2.110  -0.624  0.00  0.00    -0.285 N 
ATOM     17  H   LIG    1       -4.966   3.109  -0.524  0.00  0.00    +0.155 HD
ATOM     18  O   LIG    1       -6.980   1.980  -1.319  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1       -3.589   1.535  -0.346  0.00  0.00    +0.037 A 
ATOM     20  C   LIG    1       -2.582   2.311   0.226  0.00  0.00    +0.025 A 
ATOM     21  C   LIG    1       -1.337   1.740   0.500  0.00  0.00    +0.028 A 
ENDBRANCH   6  10
BRANCH   5  22
ATOM     22  C   LIG    1       -0.509  -2.401   1.762  0.00  0.00    +0.055 A 
ATOM     23  C   LIG    1       -1.794  -2.200   2.205  0.00  0.00    +0.116 A 
ATOM     24  N   LIG    1       -2.149  -3.347   2.860  0.00  0.00    -0.284 N 
ATOM     25  H   LIG    1       -3.027  -3.559   3.323  0.00  0.00    +0.188 HD
ATOM     26  N   LIG    1       -1.180  -4.275   2.880  0.00  0.00    -0.182 NA
ATOM     27  C   LIG    1       -0.173  -3.689   2.225  0.00  0.00    +0.145 A 
ENDBRANCH   5  22
BRANCH   1  31
ATOM     28  C   LIG    1        7.862   0.664  -0.236  0.00  0.00    +0.128 C 
ATOM     29  N   LIG    1        6.458   0.380  -0.074  0.00  0.00    -0.314 N 
ATOM     30  H   LIG    1        6.172  -0.100   0.769  0.00  0.00    +0.149 HD
ATOM     31  C   LIG    1        5.514   1.074  -0.803  0.00  0.00    +0.244 C 
ATOM     32  O   LIG    1        5.798   1.909  -1.654  0.00  0.00    -0.270 OA
ENDBRANCH   1  31
TORSDOF 3