REMARK  Name = BDB007643
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.378   2.064  -1.518  0.00  0.00    -0.269 OA
ATOM      2  C   LIG    1       -0.777   1.012  -2.006  0.00  0.00    +0.262 C 
ATOM      3  N   LIG    1        0.068   0.168  -2.692  0.00  0.00    -0.308 N 
ATOM      4  H   LIG    1       -0.210  -0.780  -2.899  0.00  0.00    +0.149 HD
ENDROOT
BRANCH   2   5
ATOM      5  C   LIG    1       -2.130   0.549  -1.867  0.00  0.00    +0.122 A 
ATOM      6  N   LIG    1       -2.765  -0.377  -2.645  0.00  0.00    -0.271 N 
ATOM      7  H   LIG    1       -2.405  -0.861  -3.459  0.00  0.00    +0.189 HD
ATOM      8  N   LIG    1       -4.024  -0.640  -2.272  0.00  0.00    -0.158 NA
ATOM      9  C   LIG    1       -4.245   0.192  -1.258  0.00  0.00    +0.141 A 
ATOM     10  C   LIG    1       -3.101   0.966  -0.975  0.00  0.00    +0.077 A 
BRANCH   9  11
ATOM     11  N   LIG    1       -5.435   0.249  -0.629  0.00  0.00    -0.325 N 
ATOM     12  H   LIG    1       -6.065  -0.509  -0.887  0.00  0.00    +0.148 HD
BRANCH  11  13
ATOM     13  C   LIG    1       -5.600   0.694   0.752  0.00  0.00    +0.076 C 
ATOM     14  C   LIG    1       -7.019   1.234   0.935  0.00  0.00    +0.050 C 
ATOM     15  C   LIG    1       -8.072   0.130   0.862  0.00  0.00    +0.161 C 
ATOM     16  O   LIG    1       -7.572  -1.160   1.214  0.00  0.00    -0.380 OA
ATOM     17  C   LIG    1       -6.596  -1.107   2.247  0.00  0.00    +0.161 C 
ATOM     18  C   LIG    1       -5.319  -0.453   1.732  0.00  0.00    +0.050 C 
ENDBRANCH  11  13
ENDBRANCH   9  11
ENDBRANCH   2   5
BRANCH   3  19
ATOM     19  C   LIG    1        1.482   0.472  -2.869  0.00  0.00    +0.137 C 
BRANCH  19  20
ATOM     20  C   LIG    1        2.377  -0.100  -1.753  0.00  0.00    +0.145 C 
BRANCH  20  21
ATOM     21  O   LIG    1        2.048  -1.490  -1.590  0.00  0.00    -0.389 OA
ATOM     22  H   LIG    1        1.262  -1.524  -1.017  0.00  0.00    +0.210 HD
ENDBRANCH  20  21
BRANCH  20  23
ATOM     23  C   LIG    1        2.252   0.683  -0.418  0.00  0.00    +0.117 C 
BRANCH  23  24
ATOM     24  N   LIG    1        3.294   0.445   0.595  0.00  0.00    -0.295 NA
ATOM     25  C   LIG    1        4.566   1.113   0.276  0.00  0.00    +0.120 C 
ATOM     26  C   LIG    1        5.815   0.445   0.809  0.00  0.00    -0.030 A 
ATOM     27  C   LIG    1        5.861  -0.956   0.911  0.00  0.00    -0.042 A 
ATOM     28  C   LIG    1        7.043  -1.596   1.295  0.00  0.00    +0.004 A 
ATOM     29  C   LIG    1        8.176  -0.841   1.597  0.00  0.00    +0.000 A 
ATOM     30  C   LIG    1        8.135   0.549   1.505  0.00  0.00    +0.000 A 
ATOM     31  C   LIG    1        4.609  -1.722   0.585  0.00  0.00    +0.051 C 
ATOM     32  C   LIG    1        6.962   1.191   1.104  0.00  0.00    +0.005 A 
ATOM     33  C   LIG    1        3.396  -0.930   1.089  0.00  0.00    +0.089 C 
ENDBRANCH  23  24
ENDBRANCH  20  23
ENDBRANCH  19  20
ENDBRANCH   3  19
TORSDOF 8