REMARK  Name = BDB037010
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.067  -1.648   0.213  0.00  0.00    +0.040 A 
ATOM      2  C   LIG    1        0.228  -1.183   0.010  0.00  0.00    +0.070 A 
ATOM      3  C   LIG    1        0.717   0.175  -0.242  0.00  0.00    +0.256 C 
ATOM      4  N   LIG    1        2.076   0.093  -0.379  0.00  0.00    -0.222 N 
ATOM      5  C   LIG    1        2.519  -1.182  -0.178  0.00  0.00    +0.255 C 
ATOM      6  O   LIG    1        3.659  -1.603  -0.188  0.00  0.00    -0.270 OA
ATOM      7  O   LIG    1        0.011   1.167  -0.256  0.00  0.00    -0.269 OA
ATOM      8  C   LIG    1        1.339  -2.008   0.061  0.00  0.00    +0.051 A 
ATOM      9  C   LIG    1        1.241  -3.362   0.304  0.00  0.00    +0.014 A 
ATOM     10  C   LIG    1       -0.042  -3.875   0.487  0.00  0.00    +0.003 A 
ATOM     11  C   LIG    1       -1.177  -3.032   0.431  0.00  0.00    +0.024 A 
ENDROOT
BRANCH   4  12
ATOM     12  C   LIG    1        2.925   1.253  -0.613  0.00  0.00    +0.171 C 
ATOM     13  C   LIG    1        3.785   1.016  -1.853  0.00  0.00    +0.240 C 
ATOM     14  O   LIG    1        3.302   0.748  -2.953  0.00  0.00    -0.273 OA
ATOM     15  N   LIG    1        5.146   1.061  -1.682  0.00  0.00    -0.255 N 
ATOM     16  H   LIG    1        5.694   0.884  -2.513  0.00  0.00    +0.158 HD
ATOM     17  C   LIG    1        5.843   0.953  -0.506  0.00  0.00    +0.219 C 
ATOM     18  O   LIG    1        7.059   0.778  -0.511  0.00  0.00    -0.275 OA
ATOM     19  C   LIG    1        5.046   1.006   0.775  0.00  0.00    +0.098 C 
ATOM     20  C   LIG    1        3.722   1.726   0.601  0.00  0.00    +0.041 C 
ENDBRANCH   4  12
BRANCH   1  21
ATOM     21  N   LIG    1       -2.166  -0.803   0.064  0.00  0.00    -0.338 N 
ATOM     22  H   LIG    1       -1.898   0.184   0.145  0.00  0.00    +0.146 HD
BRANCH  21  23
ATOM     23  C   LIG    1       -3.411  -1.088   0.784  0.00  0.00    +0.160 C 
BRANCH  23  28
ATOM     24  C   LIG    1       -6.475   2.689  -0.445  0.00  0.00    +0.174 C 
ATOM     25  N   LIG    1       -5.787   1.591   0.176  0.00  0.00    -0.254 N 
ATOM     26  N   LIG    1       -6.196   1.124   1.367  0.00  0.00    -0.066 NA
ATOM     27  N   LIG    1       -5.390   0.125   1.700  0.00  0.00    -0.133 NA
ATOM     28  C   LIG    1       -4.464  -0.031   0.700  0.00  0.00    +0.100 A 
ATOM     29  C   LIG    1       -4.710   0.901  -0.287  0.00  0.00    +0.134 A 
ENDBRANCH  23  28
ENDBRANCH  21  23
ENDBRANCH   1  21
TORSDOF 4