REMARK  Name = BDB018433
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -1.024  -2.333  -0.215  0.00  0.00    -0.002 A 
ATOM      2  C   LIG    1        0.434  -2.137  -0.286  0.00  0.00    +0.009 A 
ATOM      3  C   LIG    1        1.220  -3.219  -0.111  0.00  0.00    +0.098 A 
ATOM      4  N   LIG    1        0.715  -4.489   0.110  0.00  0.00    -0.318 N 
ATOM      5  C   LIG    1        1.653  -5.589   0.271  0.00  0.00    +0.152 C 
ATOM      6  C   LIG    1       -0.647  -4.746   0.155  0.00  0.00    +0.252 A 
ATOM      7  O   LIG    1       -1.156  -5.850   0.320  0.00  0.00    -0.268 OA
ATOM      8  C   LIG    1       -1.528  -3.564  -0.008  0.00  0.00    +0.079 A 
ENDROOT
BRANCH   1  12
ATOM      9  C   LIG    1       -3.831   0.813  -0.382  0.00  0.00    +0.215 A 
ATOM     10  N   LIG    1       -3.041   0.714   0.707  0.00  0.00    -0.221 NA
ATOM     11  C   LIG    1       -2.155  -0.309   0.721  0.00  0.00    +0.123 A 
ATOM     12  C   LIG    1       -2.019  -1.246  -0.302  0.00  0.00    +0.001 A 
ATOM     13  C   LIG    1       -2.858  -1.111  -1.412  0.00  0.00    +0.015 A 
ATOM     14  C   LIG    1       -3.778  -0.065  -1.454  0.00  0.00    +0.068 A 
BRANCH   9  15
ATOM     15  O   LIG    1       -4.760   1.830  -0.475  0.00  0.00    -0.477 OA
BRANCH  15  17
ATOM     16  C   LIG    1       -5.803   3.776   0.422  0.00  0.00    +0.048 C 
ATOM     17  C   LIG    1       -4.750   2.707   0.653  0.00  0.00    +0.227 C 
ENDBRANCH  15  17
ENDBRANCH   9  15
ENDBRANCH   1  12
BRANCH   2  18
ATOM     18  C   LIG    1        1.018  -0.851  -0.536  0.00  0.00    +0.022 A 
ATOM     19  C   LIG    1        2.046  -0.274   0.179  0.00  0.00    +0.123 A 
ATOM     20  N   LIG    1        2.325   0.945  -0.403  0.00  0.00    -0.238 N 
ATOM     21  N   LIG    1        1.463   1.192  -1.428  0.00  0.00    -0.174 NA
ATOM     22  C   LIG    1        0.704   0.100  -1.517  0.00  0.00    +0.143 A 
BRANCH  20  23
ATOM     23  C   LIG    1        3.319   1.917  -0.065  0.00  0.00    +0.083 A 
ATOM     24  C   LIG    1        4.443   1.658   0.742  0.00  0.00    +0.077 A 
ATOM     25  C   LIG    1        5.338   2.705   1.038  0.00  0.00    +0.021 A 
ATOM     26  C   LIG    1        5.140   3.990   0.533  0.00  0.00    +0.001 A 
ATOM     27  C   LIG    1        4.049   4.244  -0.287  0.00  0.00    +0.002 A 
ATOM     28  C   LIG    1        3.150   3.218  -0.588  0.00  0.00    +0.029 A 
BRANCH  24  29
ATOM     29  C   LIG    1        4.809   0.363   1.237  0.00  0.00    +0.101 C 
ATOM     30  N   LIG    1        5.121  -0.679   1.642  0.00  0.00    -0.191 NA
ENDBRANCH  24  29
ENDBRANCH  20  23
ENDBRANCH   2  18
TORSDOF 6