REMARK  Name = BDB000953
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.349   0.191  -0.423  0.00  0.00    +0.111 A 
ATOM      2  N   LIG    1       -2.365  -0.503   0.185  0.00  0.00    -0.341 N 
ATOM      3  H   LIG    1       -2.260  -1.331   0.756  0.00  0.00    +0.167 HD
ATOM      4  C   LIG    1       -3.555   0.098  -0.137  0.00  0.00    +0.078 A 
ATOM      5  C   LIG    1       -3.191   1.137  -0.986  0.00  0.00    +0.090 A 
ATOM      6  C   LIG    1       -4.188   1.944  -1.556  0.00  0.00    +0.030 A 
ATOM      7  C   LIG    1       -5.531   1.668  -1.269  0.00  0.00    +0.003 A 
ATOM      8  C   LIG    1       -5.875   0.620  -0.413  0.00  0.00    +0.015 A 
ATOM      9  C   LIG    1       -4.889  -0.176   0.190  0.00  0.00    +0.062 A 
ATOM     10  N   LIG    1       -1.828   1.194  -1.131  0.00  0.00    -0.232 NA
ENDROOT
BRANCH   1  14
ATOM     11  N   LIG    1        2.844  -0.351  -0.152  0.00  0.00    -0.302 NA
ATOM     12  C   LIG    1        2.250  -0.746  -1.445  0.00  0.00    +0.085 C 
ATOM     13  C   LIG    1        0.791  -0.305  -1.618  0.00  0.00    +0.026 C 
ATOM     14  C   LIG    1        0.090  -0.194  -0.264  0.00  0.00    +0.057 C 
ATOM     15  C   LIG    1        0.830   0.806   0.640  0.00  0.00    +0.026 C 
ATOM     16  C   LIG    1        2.315   0.943   0.285  0.00  0.00    +0.085 C 
BRANCH  11  17
ATOM     17  C   LIG    1        4.313  -0.374  -0.244  0.00  0.00    +0.084 C 
BRANCH  17  19
ATOM     18  C   LIG    1        6.498  -0.538   1.003  0.00  0.00    +0.005 C 
ATOM     19  C   LIG    1        4.989  -0.391   1.133  0.00  0.00    +0.012 C 
ENDBRANCH  17  19
ENDBRANCH  11  17
ENDBRANCH   1  14
BRANCH   9  20
ATOM     20  C   LIG    1       -5.278  -1.261   1.111  0.00  0.00    +0.244 C 
ATOM     21  O   LIG    1       -6.323  -1.881   0.979  0.00  0.00    -0.270 OA
ATOM     22  N   LIG    1       -4.434  -1.502   2.164  0.00  0.00    -0.325 N 
ATOM     23  H   LIG    1       -4.828  -2.117   2.866  0.00  0.00    +0.145 HD
ATOM     24  H   LIG    1       -3.879  -0.734   2.521  0.00  0.00    +0.145 HD
ENDBRANCH   9  20
TORSDOF 4