REMARK  Name = BDB032470
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.044  -0.159  -0.186  0.00  0.00    +0.215 A 
ATOM      2  N   LIG    1        1.171   0.853   0.694  0.00  0.00    -0.221 NA
ATOM      3  C   LIG    1        0.289   1.869   0.577  0.00  0.00    +0.115 A 
ATOM      4  C   LIG    1       -0.707   1.923  -0.385  0.00  0.00    +0.025 A 
ATOM      5  C   LIG    1       -0.831   0.863  -1.287  0.00  0.00    -0.024 A 
ATOM      6  C   LIG    1        0.083  -0.192  -1.186  0.00  0.00    +0.072 A 
ENDROOT
BRANCH   1   7
ATOM      7  O   LIG    1        1.919  -1.224  -0.158  0.00  0.00    -0.476 OA
BRANCH   7   8
ATOM      8  C   LIG    1        2.798  -1.289   0.967  0.00  0.00    +0.234 C 
BRANCH   8  14
ATOM      9  C   LIG    1        8.277  -0.247  -0.282  0.00  0.00    +0.132 C 
ATOM     10  N   LIG    1        6.907  -0.450   0.147  0.00  0.00    -0.305 N 
ATOM     11  C   LIG    1        6.651  -1.415   1.117  0.00  0.00    +0.216 C 
ATOM     12  O   LIG    1        7.495  -2.193   1.553  0.00  0.00    -0.276 OA
ATOM     13  C   LIG    1        5.228  -1.416   1.641  0.00  0.00    +0.103 C 
ATOM     14  C   LIG    1        4.251  -1.158   0.497  0.00  0.00    +0.037 C 
ATOM     15  C   LIG    1        4.532   0.202  -0.163  0.00  0.00    +0.026 C 
ATOM     16  C   LIG    1        5.980   0.660   0.001  0.00  0.00    +0.108 C 
ENDBRANCH   8  14
ENDBRANCH   7   8
ENDBRANCH   1   7
BRANCH   5  17
ATOM     17  C   LIG    1       -1.866   0.853  -2.386  0.00  0.00    +0.137 C 
BRANCH  17  18
ATOM     18  N   LIG    1       -3.067   1.615  -2.049  0.00  0.00    -0.340 N 
ATOM     19  H   LIG    1       -3.410   2.147  -2.845  0.00  0.00    +0.146 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -4.117   1.030  -1.335  0.00  0.00    +0.028 A 
ATOM     21  C   LIG    1       -3.973  -0.082  -0.497  0.00  0.00    +0.031 A 
ATOM     22  C   LIG    1       -5.046  -0.592   0.263  0.00  0.00    -0.011 A 
ATOM     23  C   LIG    1       -6.306   0.036   0.216  0.00  0.00    +0.022 A 
ATOM     24  C   LIG    1       -7.346  -0.523   1.000  0.00  0.00    +0.124 A 
ATOM     25  N   LIG    1       -7.179  -1.610   1.775  0.00  0.00    -0.240 NA
ATOM     26  C   LIG    1       -5.960  -2.179   1.800  0.00  0.00    +0.113 A 
ATOM     27  C   LIG    1       -6.440   1.182  -0.597  0.00  0.00    +0.014 A 
ATOM     28  C   LIG    1       -4.878  -1.716   1.075  0.00  0.00    +0.028 A 
ATOM     29  C   LIG    1       -5.360   1.671  -1.342  0.00  0.00    +0.023 A 
BRANCH  24  30
ATOM     30  N   LIG    1       -8.633   0.042   1.013  0.00  0.00    -0.343 N 
ATOM     31  H   LIG    1       -8.570   0.998   1.345  0.00  0.00    +0.144 HD
ATOM     32  H   LIG    1       -9.004   0.045   0.070  0.00  0.00    +0.144 HD
ENDBRANCH  24  30
ENDBRANCH  18  20
ENDBRANCH  17  18
ENDBRANCH   5  17
TORSDOF 7