REMARK  Name = BDB015927
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  C   LIG    1        0.240   0.001   0.192  0.00  0.00    +0.162 A 
ATOM      2  N   LIG    1       -1.046   0.382   0.070  0.00  0.00    -0.212 NA
ATOM      3  C   LIG    1       -1.994  -0.570  -0.044  0.00  0.00    +0.130 A 
ATOM      4  C   LIG    1       -1.665  -1.927  -0.055  0.00  0.00    +0.043 A 
ATOM      5  C   LIG    1       -0.318  -2.209   0.086  0.00  0.00    +0.125 A 
ATOM      6  N   LIG    1        0.647  -1.279   0.221  0.00  0.00    -0.235 NA
ENDROOT
BRANCH   1   9
ATOM      7  C   LIG    1        3.598   1.752   0.683  0.00  0.00    -0.014 A 
ATOM      8  C   LIG    1        2.613   0.755   0.574  0.00  0.00    +0.020 A 
ATOM      9  C   LIG    1        1.262   1.061   0.303  0.00  0.00    +0.020 A 
ATOM     10  C   LIG    1        0.931   2.418   0.139  0.00  0.00    +0.011 A 
ATOM     11  C   LIG    1        1.897   3.422   0.240  0.00  0.00    +0.001 A 
ATOM     12  C   LIG    1        3.223   3.089   0.511  0.00  0.00    +0.008 A 
BRANCH   7  17
ATOM     13  C   LIG    1        7.676  -0.564   2.325  0.00  0.00    +0.172 C 
ATOM     14  N   LIG    1        6.775   0.375   1.702  0.00  0.00    -0.274 N 
ATOM     15  N   LIG    1        7.274   1.462   1.089  0.00  0.00    -0.179 NA
ATOM     16  C   LIG    1        6.185   2.092   0.638  0.00  0.00    +0.142 A 
ATOM     17  C   LIG    1        4.985   1.414   0.961  0.00  0.00    +0.020 A 
ATOM     18  C   LIG    1        5.413   0.302   1.658  0.00  0.00    +0.116 A 
ENDBRANCH   7  17
ENDBRANCH   1   9
BRANCH   4  19
ATOM     19  C   LIG    1       -2.634  -2.995  -0.220  0.00  0.00    +0.024 A 
ATOM     20  C   LIG    1       -2.615  -4.197   0.460  0.00  0.00    +0.116 A 
ATOM     21  N   LIG    1       -3.696  -4.904   0.014  0.00  0.00    -0.274 N 
ATOM     22  C   LIG    1       -4.103  -6.224   0.430  0.00  0.00    +0.172 C 
ATOM     23  N   LIG    1       -4.422  -4.247  -0.906  0.00  0.00    -0.179 NA
ATOM     24  C   LIG    1       -3.770  -3.090  -1.056  0.00  0.00    +0.143 A 
ENDBRANCH   4  19
BRANCH   3  25
ATOM     25  N   LIG    1       -3.341  -0.167  -0.178  0.00  0.00    -0.328 N 
ATOM     26  H   LIG    1       -3.897  -0.690   0.496  0.00  0.00    +0.147 HD
BRANCH  25  27
ATOM     27  C   LIG    1       -3.609   1.268  -0.096  0.00  0.00    +0.104 C 
BRANCH  27  28
ATOM     28  C   LIG    1       -3.358   1.961  -1.437  0.00  0.00    +0.033 C 
BRANCH  28  29
ATOM     29  C   LIG    1       -3.716   3.443  -1.351  0.00  0.00    +0.079 C 
BRANCH  29  30
ATOM     30  N   LIG    1       -3.460   4.114  -2.621  0.00  0.00    -0.330 NA
ATOM     31  H   LIG    1       -3.790   5.077  -2.573  0.00  0.00    +0.118 HD
ATOM     32  H   LIG    1       -3.991   3.663  -3.365  0.00  0.00    +0.118 HD
ENDBRANCH  29  30
ENDBRANCH  28  29
ENDBRANCH  27  28
ENDBRANCH  25  27
ENDBRANCH   3  25
TORSDOF 8