REMARK  Name = BDB014232
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.861  -1.702  -0.456  0.00  0.00    +0.023 A 
ATOM      2  N   LIG    1        1.320  -0.406  -0.375  0.00  0.00    -0.356 N 
ATOM      3  H   LIG    1        0.802   0.425  -0.639  0.00  0.00    +0.166 HD
ATOM      4  C   LIG    1        2.588  -0.376   0.156  0.00  0.00    +0.079 A 
ATOM      5  C   LIG    1        2.949  -1.693   0.414  0.00  0.00    +0.090 A 
ATOM      6  N   LIG    1        4.144  -2.045   0.944  0.00  0.00    -0.253 NA
ATOM      7  C   LIG    1        4.975  -1.016   1.213  0.00  0.00    +0.112 A 
ATOM      8  C   LIG    1        4.697   0.323   0.991  0.00  0.00    +0.037 A 
ATOM      9  C   LIG    1        3.463   0.675   0.443  0.00  0.00    +0.086 A 
ATOM     10  C   LIG    1        1.867  -2.519   0.028  0.00  0.00    +0.051 A 
ENDROOT
BRANCH   9  11
ATOM     11  C   LIG    1        3.151   2.095   0.200  0.00  0.00    +0.339 C 
ATOM     12  O   LIG    1        3.886   3.032   0.449  0.00  0.00    -0.245 OA
BRANCH  11  13
ATOM     13  O   LIG    1        1.935   2.286  -0.344  0.00  0.00    -0.477 OA
ATOM     14  H   LIG    1        1.878   3.262  -0.437  0.00  0.00    +0.295 HD
ENDBRANCH  11  13
ENDBRANCH   9  11
BRANCH   1  15
ATOM     15  C   LIG    1       -0.491  -2.038  -1.000  0.00  0.00    +0.088 C 
BRANCH  15  18
ATOM     16  C   LIG    1       -3.171   0.676  -0.736  0.00  0.00    +0.120 A 
ATOM     17  C   LIG    1       -2.168  -0.157  -1.242  0.00  0.00    +0.049 A 
ATOM     18  C   LIG    1       -1.591  -1.161  -0.450  0.00  0.00    -0.038 A 
ATOM     19  C   LIG    1       -2.033  -1.317   0.870  0.00  0.00    +0.004 A 
ATOM     20  C   LIG    1       -3.033  -0.490   1.379  0.00  0.00    +0.004 A 
ATOM     21  C   LIG    1       -3.602   0.505   0.579  0.00  0.00    +0.045 A 
BRANCH  16  23
ATOM     22  C   LIG    1       -4.695   2.447  -1.172  0.00  0.00    +0.277 C 
ATOM     23  O   LIG    1       -3.636   1.610  -1.621  0.00  0.00    -0.495 OA
ENDBRANCH  16  23
ENDBRANCH  15  18
ENDBRANCH   1  15
TORSDOF 5