REMARK  Name = BDB015834
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.022  -1.074   0.163  0.00  0.00    +0.072 A 
ATOM      2  C   LIG    1       -0.155  -0.438   1.049  0.00  0.00    -0.010 A 
ATOM      3  C   LIG    1       -0.600   0.315   2.268  0.00  0.00    +0.047 C 
ATOM      4  C   LIG    1        1.241  -0.595   0.675  0.00  0.00    +0.048 A 
ATOM      5  C   LIG    1        1.352  -1.360  -0.471  0.00  0.00    +0.060 A 
ATOM      6  S   LIG    1       -0.146  -1.891  -1.070  0.00  0.00    -0.081 S 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        2.387  -0.006   1.382  0.00  0.00    +0.245 C 
ATOM      8  N   LIG    1        3.585  -0.658   1.197  0.00  0.00    -0.307 N 
ATOM      9  H   LIG    1        3.570  -1.594   0.813  0.00  0.00    +0.149 HD
ATOM     10  O   LIG    1        2.279   0.986   2.097  0.00  0.00    -0.270 OA
BRANCH   8  11
ATOM     11  C   LIG    1        4.774  -0.293   1.932  0.00  0.00    +0.145 C 
BRANCH  11  12
ATOM     12  C   LIG    1        5.946  -0.316   0.999  0.00  0.00    +0.037 A 
ATOM     13  C   LIG    1        6.515  -1.676   0.729  0.00  0.00    +0.254 A 
ATOM     14  O   LIG    1        5.998  -2.696   1.176  0.00  0.00    -0.268 OA
ATOM     15  N   LIG    1        7.635  -1.729  -0.061  0.00  0.00    -0.326 N 
ATOM     16  H   LIG    1        8.004  -2.657  -0.229  0.00  0.00    +0.169 HD
ATOM     17  C   LIG    1        8.235  -0.635  -0.632  0.00  0.00    +0.016 A 
ATOM     18  C   LIG    1        9.445  -0.883  -1.478  0.00  0.00    +0.063 C 
ATOM     19  C   LIG    1        7.715   0.581  -0.412  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1        6.538   0.756   0.427  0.00  0.00    -0.039 A 
ATOM     21  C   LIG    1        6.069   2.179   0.568  0.00  0.00    +0.044 C 
ENDBRANCH  11  12
ENDBRANCH   8  11
ENDBRANCH   4   7
BRANCH   1  22
ATOM     22  N   LIG    1       -2.401  -1.061   0.228  0.00  0.00    -0.322 N 
BRANCH  22  23
ATOM     23  C   LIG    1       -3.048   0.234  -0.139  0.00  0.00    +0.074 C 
ATOM     24  C   LIG    1       -3.425   0.311  -1.629  0.00  0.00    +0.024 C 
ATOM     25  C   LIG    1       -4.877  -0.049  -1.946  0.00  0.00    +0.020 C 
ATOM     26  C   LIG    1       -5.882   0.710  -1.054  0.00  0.00    +0.056 C 
ATOM     27  C   LIG    1       -5.592   0.263   0.394  0.00  0.00    +0.020 C 
ATOM     28  C   LIG    1       -4.172   0.603   0.848  0.00  0.00    +0.024 C 
BRANCH  26  29
ATOM     29  N   LIG    1       -5.816   2.185  -1.232  0.00  0.00    -0.305 NA
ATOM     30  C   LIG    1       -6.759   2.893  -0.356  0.00  0.00    +0.104 C 
ATOM     31  C   LIG    1       -6.086   2.587  -2.619  0.00  0.00    +0.104 C 
ENDBRANCH  26  29
ENDBRANCH  22  23
BRANCH  22  33
ATOM     32  C   LIG    1       -2.823  -3.361   1.030  0.00  0.00    +0.024 C 
ATOM     33  C   LIG    1       -3.130  -2.310  -0.031  0.00  0.00    +0.102 C 
ENDBRANCH  22  33
ENDBRANCH   1  22
TORSDOF 7