REMARK  Name = BDB014841
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        2.819   0.271   0.488  0.00  0.00    -0.016 A 
ATOM      2  C   LIG    1        2.044  -0.896   0.533  0.00  0.00    +0.010 A 
ATOM      3  C   LIG    1        0.655  -0.857   0.337  0.00  0.00    +0.024 A 
ATOM      4  C   LIG    1       -0.010   0.346   0.091  0.00  0.00    +0.032 A 
ATOM      5  C   LIG    1        0.766   1.514   0.047  0.00  0.00    +0.024 A 
ATOM      6  C   LIG    1        2.154   1.480   0.240  0.00  0.00    +0.010 A 
ENDROOT
BRANCH   1  10
ATOM      7  C   LIG    1        7.037   0.200   1.012  0.00  0.00    +0.125 A 
ATOM      8  N   LIG    1        6.516   0.826  -0.056  0.00  0.00    -0.240 NA
ATOM      9  C   LIG    1        5.165   0.826  -0.192  0.00  0.00    +0.121 A 
ATOM     10  C   LIG    1        4.272   0.228   0.694  0.00  0.00    +0.000 A 
ATOM     11  C   LIG    1        4.846  -0.416   1.793  0.00  0.00    +0.013 A 
ATOM     12  C   LIG    1        6.234  -0.432   1.955  0.00  0.00    +0.044 A 
BRANCH   7  15
ATOM     13  C   LIG    1        9.140   1.442  -0.796  0.00  0.00    +0.109 C 
ATOM     14  C   LIG    1        9.425   0.682   0.469  0.00  0.00    +0.215 C 
ATOM     15  N   LIG    1        8.416   0.159   1.218  0.00  0.00    -0.271 N 
ATOM     16  H   LIG    1        8.754  -0.325   2.038  0.00  0.00    +0.156 HD
ATOM     17  O   LIG    1       10.586   0.516   0.858  0.00  0.00    -0.276 OA
ENDBRANCH   7  15
ENDBRANCH   1  10
BRANCH   4  18
ATOM     18  N   LIG    1       -1.404   0.450  -0.112  0.00  0.00    -0.298 N 
ATOM     19  H   LIG    1       -1.676   1.409  -0.289  0.00  0.00    +0.154 HD
BRANCH  18  20
ATOM     20  C   LIG    1       -2.392  -0.479  -0.084  0.00  0.00    +0.150 A 
ATOM     21  C   LIG    1       -3.746  -0.143  -0.355  0.00  0.00    +0.032 A 
ATOM     22  C   LIG    1       -4.379   1.152  -0.717  0.00  0.00    +0.148 C 
ATOM     23  N   LIG    1       -5.850   1.031  -0.744  0.00  0.00    -0.297 N 
ATOM     24  C   LIG    1       -6.420  -0.250  -1.219  0.00  0.00    +0.114 C 
ATOM     25  C   LIG    1       -5.903  -1.473  -0.430  0.00  0.00    +0.074 C 
ATOM     26  C   LIG    1       -6.551   2.230  -0.753  0.00  0.00    +0.213 C 
ATOM     27  O   LIG    1       -5.990   3.323  -0.656  0.00  0.00    -0.276 OA
ATOM     28  C   LIG    1       -8.051   2.157  -0.877  0.00  0.00    +0.109 C 
ATOM     29  C   LIG    1       -4.443  -1.327  -0.237  0.00  0.00    +0.047 A 
ATOM     30  N   LIG    1       -3.532  -2.273   0.105  0.00  0.00    -0.269 N 
ATOM     31  C   LIG    1       -3.755  -3.674   0.368  0.00  0.00    +0.172 C 
ATOM     32  N   LIG    1       -2.282  -1.787   0.181  0.00  0.00    -0.156 NA
ENDBRANCH  18  20
ENDBRANCH   4  18
TORSDOF 4