REMARK  Name = BDB062465
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.679  -1.692  -0.064  0.00  0.00    -0.295 NA
ATOM      2  C   LIG    1       -2.070  -2.058  -0.441  0.00  0.00    +0.103 C 
ATOM      3  C   LIG    1       -3.006  -2.261   0.768  0.00  0.00    +0.122 C 
ATOM      4  N   LIG    1       -3.142  -1.014   1.552  0.00  0.00    -0.313 N 
ATOM      5  C   LIG    1       -1.913  -0.187   1.596  0.00  0.00    +0.122 C 
ATOM      6  C   LIG    1       -0.651  -1.014   1.255  0.00  0.00    +0.103 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1       -4.273  -0.233   1.216  0.00  0.00    +0.124 A 
ATOM      8  N   LIG    1       -4.927  -0.472   0.059  0.00  0.00    -0.215 NA
ATOM      9  C   LIG    1       -5.979   0.333  -0.165  0.00  0.00    +0.140 A 
ATOM     10  C   LIG    1       -6.452   1.357   0.644  0.00  0.00    +0.019 A 
ATOM     11  C   LIG    1       -7.579   1.918  -0.015  0.00  0.00    +0.029 A 
ATOM     12  C   LIG    1       -7.761   1.226  -1.194  0.00  0.00    +0.085 A 
ATOM     13  C   LIG    1       -5.768   1.589   1.841  0.00  0.00    +0.015 A 
ATOM     14  N   LIG    1       -6.784   0.265  -1.270  0.00  0.00    -0.346 N 
ATOM     15  H   LIG    1       -6.656  -0.405  -2.013  0.00  0.00    +0.167 HD
ATOM     16  C   LIG    1       -4.668   0.771   2.114  0.00  0.00    +0.044 A 
ENDBRANCH   4   7
BRANCH   1  17
ATOM     17  C   LIG    1       -0.066  -0.894  -1.135  0.00  0.00    +0.121 C 
BRANCH  17  27
ATOM     18  C   LIG    1        6.279   0.544  -0.769  0.00  0.00    +0.019 A 
ATOM     19  C   LIG    1        5.516   1.824  -0.948  0.00  0.00    +0.252 A 
ATOM     20  O   LIG    1        6.079   2.912  -1.015  0.00  0.00    -0.268 OA
ATOM     21  N   LIG    1        4.150   1.729  -1.036  0.00  0.00    -0.321 N 
ATOM     22  H   LIG    1        3.654   2.601  -1.155  0.00  0.00    +0.169 HD
ATOM     23  C   LIG    1        3.461   0.513  -0.980  0.00  0.00    +0.068 A 
ATOM     24  C   LIG    1        4.167  -0.679  -0.828  0.00  0.00    +0.088 A 
ATOM     25  N   LIG    1        3.585  -1.894  -0.769  0.00  0.00    -0.253 NA
ATOM     26  C   LIG    1        2.233  -1.913  -0.862  0.00  0.00    +0.116 A 
ATOM     27  C   LIG    1        1.434  -0.778  -1.009  0.00  0.00    -0.013 A 
ATOM     28  C   LIG    1        2.076   0.465  -1.076  0.00  0.00    +0.034 A 
ATOM     29  C   LIG    1        5.621  -0.628  -0.728  0.00  0.00    +0.038 A 
BRANCH  18  31
ATOM     30  C   LIG    1        8.248   1.099   0.690  0.00  0.00    +0.009 C 
ATOM     31  C   LIG    1        7.777   0.642  -0.684  0.00  0.00    +0.037 C 
ENDBRANCH  18  31
ENDBRANCH  17  27
ENDBRANCH   1  17
TORSDOF 4