REMARK  Name = BDB011146
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1       -0.961  -0.097  -1.917  0.00  0.00    +0.221 A 
ATOM      2  C   LIG    1       -0.223  -1.157  -1.399  0.00  0.00    +0.044 A 
ATOM      3  C   LIG    1       -0.809  -2.425  -1.465  0.00  0.00    +0.021 A 
ATOM      4  C   LIG    1       -2.068  -2.596  -2.057  0.00  0.00    +0.004 A 
ATOM      5  C   LIG    1       -2.714  -1.453  -2.568  0.00  0.00    +0.075 A 
ATOM      6  C   LIG    1       -3.957  -1.615  -3.159  0.00  0.00    +0.032 A 
ATOM      7  C   LIG    1       -4.566  -2.871  -3.247  0.00  0.00    +0.048 A 
ATOM      8  C   LIG    1       -3.933  -4.002  -2.737  0.00  0.00    +0.121 A 
ATOM      9  C   LIG    1       -2.680  -3.862  -2.143  0.00  0.00    +0.055 A 
ATOM     10  N   LIG    1       -2.173  -0.227  -2.500  0.00  0.00    -0.213 NA
ENDROOT
BRANCH   8  11
ATOM     11  O   LIG    1       -4.634  -5.166  -2.881  0.00  0.00    -0.495 OA
ATOM     12  C   LIG    1       -4.046  -6.345  -2.345  0.00  0.00    +0.277 C 
ENDBRANCH   8  11
BRANCH   1  13
ATOM     13  O   LIG    1       -0.393   1.158  -1.833  0.00  0.00    -0.476 OA
BRANCH  13  14
ATOM     14  C   LIG    1       -1.307   2.222  -2.100  0.00  0.00    +0.231 C 
BRANCH  14  15
ATOM     15  C   LIG    1       -0.605   3.551  -1.819  0.00  0.00    +0.041 C 
BRANCH  15  16
ATOM     16  C   LIG    1       -0.000   3.668  -0.413  0.00  0.00    +0.003 C 
BRANCH  16  18
ATOM     17  C   LIG    1       -2.108   4.492   0.764  0.00  0.00    +0.004 C 
ATOM     18  C   LIG    1       -0.979   3.474   0.747  0.00  0.00    -0.003 C 
ENDBRANCH  16  18
ENDBRANCH  15  16
ENDBRANCH  14  15
ENDBRANCH  13  14
ENDBRANCH   1  13
BRANCH   2  19
ATOM     19  C   LIG    1        1.116  -0.920  -0.742  0.00  0.00    +0.161 C 
BRANCH  19  20
ATOM     20  O   LIG    1        1.915  -2.109  -0.846  0.00  0.00    -0.386 OA
ATOM     21  H   LIG    1        2.212  -2.155  -1.771  0.00  0.00    +0.210 HD
ENDBRANCH  19  20
BRANCH  19  22
ATOM     22  C   LIG    1        0.947  -0.545   0.741  0.00  0.00    +0.125 C 
BRANCH  22  23
ATOM     23  C   LIG    1        2.173   0.068   1.287  0.00  0.00    -0.099 C 
ATOM     24  C   LIG    1        3.161   0.584   1.733  0.00  0.00    -0.102 C 
BRANCH  24  25
ATOM     25  C   LIG    1        4.370   1.221   2.275  0.00  0.00    +0.089 C 
BRANCH  25  26
ATOM     26  C   LIG    1        5.053   0.344   3.329  0.00  0.00    +0.024 C 
BRANCH  26  27
ATOM     27  C   LIG    1        4.255   0.197   4.623  0.00  0.00    +0.121 C 
BRANCH  27  28
ATOM     28  C   LIG    1        4.226   1.482   5.411  0.00  0.00    +0.305 C 
ATOM     29  O   LIG    1        3.294   2.271   5.404  0.00  0.00    -0.251 OA
BRANCH  28  30
ATOM     30  O   LIG    1        5.356   1.701   6.120  0.00  0.00    -0.481 OA
ATOM     31  H   LIG    1        6.019   0.989   6.040  0.00  0.00    +0.295 HD
ENDBRANCH  28  30
ENDBRANCH  27  28
ENDBRANCH  26  27
ENDBRANCH  25  26
ENDBRANCH  24  25
ENDBRANCH  22  23
ENDBRANCH  19  22
ENDBRANCH   2  19
TORSDOF 15