REMARK  Name = BDB061337
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.689  -0.685  -2.060  0.00  0.00    -0.491 OA
ENDROOT
BRANCH   1   6
ATOM      2  C   LIG    1        3.289  -0.861  -0.766  0.00  0.00    +0.087 A 
ATOM      3  C   LIG    1        2.303  -1.704  -0.251  0.00  0.00    +0.036 A 
ATOM      4  C   LIG    1        0.974  -1.626  -0.700  0.00  0.00    -0.007 A 
ATOM      5  C   LIG    1       -0.066  -2.541  -0.112  0.00  0.00    +0.047 C 
ATOM      6  C   LIG    1        0.629  -0.688  -1.692  0.00  0.00    +0.124 A 
ATOM      7  C   LIG    1        1.617   0.146  -2.218  0.00  0.00    +0.048 A 
ATOM      8  C   LIG    1        2.937   0.056  -1.761  0.00  0.00    +0.033 A 
BRANCH   2  10
ATOM      9  N   LIG    1        4.994   0.068   0.240  0.00  0.00    -0.149 NA
ATOM     10  N   LIG    1        4.614  -0.989  -0.312  0.00  0.00    -0.149 NA
BRANCH   9  15
ATOM     11  C   LIG    1       10.345  -0.385   2.225  0.00  0.00    +0.044 C 
ATOM     12  C   LIG    1        8.949  -0.244   1.695  0.00  0.00    -0.050 A 
ATOM     13  C   LIG    1        8.695  -0.370   0.325  0.00  0.00    +0.005 A 
ATOM     14  C   LIG    1        7.390  -0.272  -0.164  0.00  0.00    +0.030 A 
ATOM     15  C   LIG    1        6.314  -0.065   0.708  0.00  0.00    +0.086 A 
ATOM     16  C   LIG    1        6.571   0.059   2.076  0.00  0.00    +0.030 A 
ATOM     17  C   LIG    1        7.875  -0.040   2.570  0.00  0.00    +0.005 A 
ENDBRANCH   9  15
ENDBRANCH   2  10
ENDBRANCH   1   6
BRANCH   1  18
ATOM     18  C   LIG    1       -1.168   0.294  -2.984  0.00  0.00    +0.233 C 
BRANCH  18  19
ATOM     19  C   LIG    1       -1.445   1.643  -2.313  0.00  0.00    +0.076 C 
BRANCH  19  20
ATOM     20  C   LIG    1       -2.629   1.593  -1.375  0.00  0.00    -0.044 A 
ATOM     21  C   LIG    1       -2.458   1.207  -0.039  0.00  0.00    +0.007 A 
ATOM     22  C   LIG    1       -3.553   1.147   0.824  0.00  0.00    +0.046 A 
ATOM     23  C   LIG    1       -4.830   1.446   0.352  0.00  0.00    +0.122 A 
ATOM     24  C   LIG    1       -5.009   1.862  -0.963  0.00  0.00    +0.046 A 
ATOM     25  C   LIG    1       -3.913   1.924  -1.828  0.00  0.00    +0.007 A 
BRANCH  23  26
ATOM     26  O   LIG    1       -5.861   1.394   1.246  0.00  0.00    -0.475 OA
BRANCH  26  27
ATOM     27  C   LIG    1       -6.804   0.316   1.079  0.00  0.00    +0.200 C 
ATOM     28  C   LIG    1       -7.511   0.220   2.443  0.00  0.00    +0.067 C 
ATOM     29  C   LIG    1       -6.133  -1.040   0.791  0.00  0.00    +0.067 C 
BRANCH  27  30
ATOM     30  C   LIG    1       -7.912   0.632   0.055  0.00  0.00    +0.348 C 
ATOM     31  O   LIG    1       -8.215   1.726  -0.396  0.00  0.00    -0.247 OA
BRANCH  30  32
ATOM     32  O   LIG    1       -8.638  -0.447  -0.313  0.00  0.00    -0.478 OA
ATOM     33  H   LIG    1       -9.305  -0.077  -0.930  0.00  0.00    +0.295 HD
ENDBRANCH  30  32
ENDBRANCH  27  30
ENDBRANCH  26  27
ENDBRANCH  23  26
ENDBRANCH  19  20
ENDBRANCH  18  19
ENDBRANCH   1  18
TORSDOF 10