REMARK  Name = BDB001030
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.430  -0.831   0.745  0.00  0.00    +0.035 A 
ATOM      2  C   LIG    1       -0.583  -0.263  -0.211  0.00  0.00    +0.028 A 
ATOM      3  C   LIG    1        0.779  -0.225   0.051  0.00  0.00    -0.032 A 
ATOM      4  C   LIG    1        1.880   0.334  -0.812  0.00  0.00    +0.073 C 
ATOM      5  C   LIG    1        3.079   0.054   0.051  0.00  0.00    -0.011 A 
ATOM      6  C   LIG    1        4.478   0.362  -0.228  0.00  0.00    -0.007 A 
ATOM      7  C   LIG    1        5.444   0.004   0.735  0.00  0.00    +0.047 A 
ATOM      8  C   LIG    1        6.799   0.274   0.520  0.00  0.00    +0.014 A 
ATOM      9  C   LIG    1        7.199   0.903  -0.659  0.00  0.00    +0.001 A 
ATOM     10  C   LIG    1        6.248   1.261  -1.617  0.00  0.00    +0.001 A 
ATOM     11  C   LIG    1        5.014  -0.671   2.000  0.00  0.00    +0.257 A 
ATOM     12  O   LIG    1        5.819  -1.000   2.864  0.00  0.00    -0.267 OA
ATOM     13  N   LIG    1        3.661  -0.906   2.145  0.00  0.00    -0.321 N 
ATOM     14  H   LIG    1        3.371  -1.361   2.999  0.00  0.00    +0.169 HD
ATOM     15  C   LIG    1        4.892   0.992  -1.405  0.00  0.00    +0.009 A 
ATOM     16  C   LIG    1        2.753  -0.551   1.201  0.00  0.00    +0.054 A 
ATOM     17  C   LIG    1        1.315  -0.745   1.240  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1        0.493  -1.315   2.193  0.00  0.00    +0.012 A 
ATOM     19  C   LIG    1       -0.884  -1.356   1.937  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   1  23
ATOM     20  N   LIG    1       -4.918  -0.777  -0.277  0.00  0.00    -0.299 N 
ATOM     21  H   LIG    1       -5.029  -1.717   0.074  0.00  0.00    +0.150 HD
ATOM     22  C   LIG    1       -3.601  -0.373  -0.411  0.00  0.00    +0.304 C 
ATOM     23  N   LIG    1       -2.826  -0.932   0.584  0.00  0.00    -0.269 N 
ATOM     24  H   LIG    1       -3.344  -1.327   1.354  0.00  0.00    +0.156 HD
ATOM     25  O   LIG    1       -3.227   0.386  -1.294  0.00  0.00    -0.253 OA
BRANCH  20  26
ATOM     26  C   LIG    1       -5.918  -0.340  -1.233  0.00  0.00    +0.105 C 
BRANCH  26  28
ATOM     27  C   LIG    1       -7.076   1.296   0.324  0.00  0.00    +0.005 C 
ATOM     28  C   LIG    1       -6.370   1.103  -1.010  0.00  0.00    +0.015 C 
ENDBRANCH  26  28
ENDBRANCH  20  26
ENDBRANCH   1  23
TORSDOF 3