REMARK  Name = BDB014995
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  O   LIG    1       -0.107   0.778   1.978  0.00  0.00    -0.489 OA
ENDROOT
BRANCH   1   5
ATOM      2  C   LIG    1        3.389  -0.329  -0.054  0.00  0.00    +0.002 A 
ATOM      3  C   LIG    1        2.193  -1.006  -0.335  0.00  0.00    +0.013 A 
ATOM      4  C   LIG    1        1.000  -0.668   0.321  0.00  0.00    +0.046 A 
ATOM      5  C   LIG    1        0.983   0.353   1.270  0.00  0.00    +0.121 A 
ATOM      6  C   LIG    1        2.167   1.032   1.555  0.00  0.00    +0.046 A 
ATOM      7  C   LIG    1        3.357   0.696   0.902  0.00  0.00    +0.013 A 
BRANCH   2  10
ATOM      8  N   LIG    1        6.717  -0.620  -1.239  0.00  0.00    -0.268 N 
ATOM      9  N   LIG    1        5.798  -0.051  -0.441  0.00  0.00    -0.171 NA
ATOM     10  C   LIG    1        4.644  -0.676  -0.734  0.00  0.00    +0.093 A 
ATOM     11  C   LIG    1        4.864  -1.654  -1.745  0.00  0.00    +0.049 A 
ATOM     12  C   LIG    1        6.204  -1.591  -2.045  0.00  0.00    +0.109 A 
BRANCH   8  14
ATOM     13  C   LIG    1        8.716  -0.399   0.196  0.00  0.00    +0.032 C 
ATOM     14  C   LIG    1        8.108  -0.181  -1.189  0.00  0.00    +0.101 C 
ATOM     15  C   LIG    1        8.249   1.273  -1.637  0.00  0.00    +0.032 C 
ENDBRANCH   8  14
ENDBRANCH   2  10
ENDBRANCH   1   5
BRANCH   1  16
ATOM     16  C   LIG    1       -1.350   0.106   1.722  0.00  0.00    +0.261 C 
BRANCH  16  17
ATOM     17  C   LIG    1       -2.411   0.756   2.621  0.00  0.00    +0.166 C 
BRANCH  17  18
ATOM     18  O   LIG    1       -2.019   0.609   3.997  0.00  0.00    -0.387 OA
ATOM     19  H   LIG    1       -1.076   0.863   4.029  0.00  0.00    +0.210 HD
ENDBRANCH  17  18
BRANCH  17  20
ATOM     20  C   LIG    1       -3.801   0.115   2.443  0.00  0.00    +0.119 C 
BRANCH  20  21
ATOM     21  N   LIG    1       -4.324   0.134   1.065  0.00  0.00    -0.295 NA
ATOM     22  C   LIG    1       -5.501  -0.756   0.969  0.00  0.00    +0.120 C 
ATOM     23  C   LIG    1       -6.200  -0.701  -0.372  0.00  0.00    -0.030 A 
ATOM     24  C   LIG    1       -6.037   0.404  -1.226  0.00  0.00    -0.042 A 
ATOM     25  C   LIG    1       -6.721   0.448  -2.447  0.00  0.00    +0.004 A 
ATOM     26  C   LIG    1       -7.583  -0.587  -2.810  0.00  0.00    +0.000 A 
ATOM     27  C   LIG    1       -7.762  -1.674  -1.958  0.00  0.00    +0.000 A 
ATOM     28  C   LIG    1       -5.078   1.504  -0.852  0.00  0.00    +0.051 C 
ATOM     29  C   LIG    1       -7.078  -1.730  -0.744  0.00  0.00    +0.005 A 
ATOM     30  C   LIG    1       -4.709   1.490   0.638  0.00  0.00    +0.089 C 
ENDBRANCH  20  21
ENDBRANCH  17  20
ENDBRANCH  16  17
ENDBRANCH   1  16
TORSDOF 8