REMARK  Name = BDB034377
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        0.383   1.120   0.339  0.00  0.00    -0.343 N 
ATOM      2  H   LIG    1        0.932   1.042   1.191  0.00  0.00    +0.146 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1        1.232   1.355  -0.764  0.00  0.00    +0.038 A 
ATOM      4  C   LIG    1        2.484   0.675  -0.856  0.00  0.00    +0.021 A 
ATOM      5  C   LIG    1        3.296   0.929  -1.988  0.00  0.00    +0.076 A 
ATOM      6  C   LIG    1        4.530   0.305  -2.095  0.00  0.00    +0.074 A 
ATOM      7  C   LIG    1        4.995  -0.569  -1.113  0.00  0.00    +0.130 A 
ATOM      8  C   LIG    1        4.197  -0.868  -0.016  0.00  0.00    +0.047 A 
ATOM      9  N   LIG    1        2.927   1.748  -2.982  0.00  0.00    -0.255 NA
ATOM     10  C   LIG    1        1.715   2.325  -2.901  0.00  0.00    +0.113 A 
ATOM     11  C   LIG    1        2.955  -0.247   0.112  0.00  0.00    +0.015 A 
ATOM     12  C   LIG    1        0.845   2.154  -1.840  0.00  0.00    +0.043 A 
BRANCH   7  13
ATOM     13  O   LIG    1        6.217  -1.163  -1.329  0.00  0.00    -0.456 OA
BRANCH  13  14
ATOM     14  C   LIG    1        7.093  -1.204  -0.268  0.00  0.00    +0.128 A 
ATOM     15  C   LIG    1        7.408  -0.072   0.489  0.00  0.00    +0.046 A 
ATOM     16  C   LIG    1        8.331  -0.172   1.530  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1        8.948  -1.394   1.802  0.00  0.00    +0.000 A 
ATOM     18  C   LIG    1        8.650  -2.517   1.029  0.00  0.00    +0.004 A 
ATOM     19  C   LIG    1        7.727  -2.420  -0.013  0.00  0.00    +0.046 A 
ENDBRANCH  13  14
ENDBRANCH   7  13
ENDBRANCH   1   3
BRANCH   1  20
ATOM     20  C   LIG    1       -0.818   1.935   0.536  0.00  0.00    +0.103 C 
BRANCH  20  21
ATOM     21  C   LIG    1       -1.569   1.467   1.786  0.00  0.00    +0.034 C 
BRANCH  21  22
ATOM     22  C   LIG    1       -2.333   0.156   1.574  0.00  0.00    +0.083 C 
BRANCH  22  23
ATOM     23  N   LIG    1       -3.488   0.365   0.699  0.00  0.00    -0.312 NA
ATOM     24  H   LIG    1       -4.164   0.970   1.165  0.00  0.00    +0.122 HD
BRANCH  23  25
ATOM     25  C   LIG    1       -4.156  -0.904   0.405  0.00  0.00    +0.120 C 
BRANCH  25  27
ATOM     26  C   LIG    1       -6.667  -0.589   0.034  0.00  0.00    +0.125 A 
ATOM     27  C   LIG    1       -5.358  -0.675  -0.484  0.00  0.00    +0.011 A 
ATOM     28  C   LIG    1       -5.153  -0.507  -1.865  0.00  0.00    +0.046 A 
ATOM     29  C   LIG    1       -6.231  -0.280  -2.709  0.00  0.00    +0.124 A 
ATOM     30  F   LIG    1       -6.023  -0.125  -4.023  0.00  0.00    -0.205 F 
ATOM     31  C   LIG    1       -7.522  -0.210  -2.208  0.00  0.00    +0.042 A 
ATOM     32  C   LIG    1       -7.742  -0.361  -0.836  0.00  0.00    +0.049 A 
BRANCH  26  34
ATOM     33  C   LIG    1       -8.094  -0.681   1.946  0.00  0.00    +0.277 C 
ATOM     34  O   LIG    1       -6.786  -0.732   1.392  0.00  0.00    -0.495 OA
ENDBRANCH  26  34
ENDBRANCH  25  27
ENDBRANCH  23  25
ENDBRANCH  22  23
ENDBRANCH  21  22
ENDBRANCH  20  21
ENDBRANCH   1  20
TORSDOF 10