REMARK  Name = BDB023410
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        1.319   0.160  -0.750  0.00  0.00    -0.030 A 
ATOM      2  C   LIG    1       -0.083   0.072  -0.753  0.00  0.00    +0.013 A 
ATOM      3  C   LIG    1       -0.881   1.219  -0.632  0.00  0.00    -0.025 A 
ATOM      4  C   LIG    1       -0.258   2.468  -0.528  0.00  0.00    +0.008 A 
ATOM      5  C   LIG    1        1.134   2.567  -0.514  0.00  0.00    +0.001 A 
ATOM      6  C   LIG    1        1.919   1.419  -0.619  0.00  0.00    +0.005 A 
ENDROOT
BRANCH   3   7
ATOM      7  C   LIG    1       -2.342   1.074  -0.674  0.00  0.00    +0.013 C 
ATOM      8  C   LIG    1       -3.177   1.786   0.100  0.00  0.00    +0.068 C 
BRANCH   8   9
ATOM      9  C   LIG    1       -4.660   1.677   0.049  0.00  0.00    +0.241 C 
ATOM     10  N   LIG    1       -5.125   0.408  -0.180  0.00  0.00    -0.280 N 
ATOM     11  H   LIG    1       -4.463  -0.360  -0.234  0.00  0.00    +0.155 HD
ATOM     12  O   LIG    1       -5.323   2.687   0.256  0.00  0.00    -0.270 OA
BRANCH  10  13
ATOM     13  C   LIG    1       -6.463  -0.032  -0.254  0.00  0.00    +0.054 A 
ATOM     14  C   LIG    1       -6.645  -1.416  -0.468  0.00  0.00    +0.046 A 
ATOM     15  C   LIG    1       -7.939  -1.929  -0.606  0.00  0.00    +0.024 A 
ATOM     16  C   LIG    1       -9.045  -1.091  -0.455  0.00  0.00    +0.002 A 
ATOM     17  C   LIG    1       -8.862   0.268  -0.206  0.00  0.00    +0.002 A 
ATOM     18  C   LIG    1       -7.573   0.800  -0.113  0.00  0.00    +0.025 A 
BRANCH  14  19
ATOM     19  N   LIG    1       -5.521  -2.231  -0.783  0.00  0.00    -0.357 N 
ATOM     20  H   LIG    1       -5.731  -3.211  -0.603  0.00  0.00    +0.142 HD
ATOM     21  H   LIG    1       -5.319  -2.126  -1.779  0.00  0.00    +0.142 HD
ENDBRANCH  14  19
ENDBRANCH  10  13
ENDBRANCH   8   9
ENDBRANCH   3   7
BRANCH   1  22
ATOM     22  C   LIG    1        2.166  -1.088  -0.851  0.00  0.00    +0.137 C 
BRANCH  22  23
ATOM     23  N   LIG    1        2.496  -1.595   0.478  0.00  0.00    -0.340 N 
ATOM     24  H   LIG    1        1.675  -1.581   1.078  0.00  0.00    +0.146 HD
BRANCH  23  27
ATOM     25  C   LIG    1        5.951  -0.375   1.248  0.00  0.00    +0.122 A 
ATOM     26  C   LIG    1        4.838  -0.815   0.521  0.00  0.00    +0.068 A 
ATOM     27  C   LIG    1        3.622  -1.107   1.157  0.00  0.00    +0.031 A 
ATOM     28  C   LIG    1        3.577  -1.022   2.556  0.00  0.00    +0.023 A 
ATOM     29  C   LIG    1        4.680  -0.588   3.291  0.00  0.00    +0.005 A 
ATOM     30  C   LIG    1        5.861  -0.257   2.634  0.00  0.00    +0.046 A 
BRANCH  25  31
ATOM     31  O   LIG    1        7.173  -0.044   0.729  0.00  0.00    -0.492 OA
BRANCH  31  33
ATOM     32  C   LIG    1        8.731   0.334  -1.032  0.00  0.00    +0.048 C 
ATOM     33  C   LIG    1        7.322  -0.114  -0.687  0.00  0.00    +0.225 C 
ENDBRANCH  31  33
ENDBRANCH  25  31
ENDBRANCH  23  27
ENDBRANCH  22  23
ENDBRANCH   1  22
TORSDOF 9