REMARK  Name = BDB034723
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1        1.976  -0.983   1.293  0.00  0.00    -0.292 N 
ATOM      2  C   LIG    1        0.642  -0.587   1.114  0.00  0.00    +0.072 A 
ATOM      3  C   LIG    1        0.371   0.425   2.034  0.00  0.00    +0.070 A 
ATOM      4  C   LIG    1       -0.864   1.028   2.105  0.00  0.00    +0.030 A 
ATOM      5  C   LIG    1       -1.843   0.589   1.204  0.00  0.00    +0.025 A 
ATOM      6  C   LIG    1       -1.587  -0.434   0.260  0.00  0.00    +0.033 A 
ATOM      7  N   LIG    1        1.534   0.659   2.777  0.00  0.00    -0.295 N 
ATOM      8  C   LIG    1        1.672   1.636   3.817  0.00  0.00    +0.154 C 
ATOM      9  C   LIG    1       -0.314  -1.030   0.221  0.00  0.00    +0.051 A 
ATOM     10  C   LIG    1        2.553  -0.202   2.321  0.00  0.00    +0.330 A 
ATOM     11  O   LIG    1        3.708  -0.254   2.711  0.00  0.00    -0.246 OA
ENDROOT
BRANCH   6  12
ATOM     12  N   LIG    1       -2.553  -0.851  -0.680  0.00  0.00    -0.313 N 
ATOM     13  H   LIG    1       -2.385  -1.792  -1.034  0.00  0.00    +0.152 HD
BRANCH  12  14
ATOM     14  C   LIG    1       -3.627  -0.164  -1.291  0.00  0.00    +0.053 A 
ATOM     15  C   LIG    1       -4.770  -0.853  -1.740  0.00  0.00    +0.110 A 
ATOM     16  C   LIG    1       -5.808  -0.111  -2.288  0.00  0.00    +0.148 A 
ATOM     17 CL   LIG    1       -7.265  -0.819  -2.877  0.00  0.00    -0.061 Cl
ATOM     18  N   LIG    1       -5.800   1.235  -2.420  0.00  0.00    -0.242 NA
ATOM     19  C   LIG    1       -4.701   1.876  -1.984  0.00  0.00    +0.114 A 
ATOM     20  C   LIG    1       -3.614   1.232  -1.418  0.00  0.00    +0.044 A 
BRANCH  15  21
ATOM     21  C   LIG    1       -4.866  -2.273  -1.629  0.00  0.00    +0.104 C 
ATOM     22  N   LIG    1       -4.893  -3.430  -1.534  0.00  0.00    -0.191 NA
ENDBRANCH  15  21
ENDBRANCH  12  14
ENDBRANCH   6  12
BRANCH   1  23
ATOM     23  C   LIG    1        2.686  -1.976   0.522  0.00  0.00    +0.134 C 
BRANCH  23  24
ATOM     24  C   LIG    1        3.541  -1.361  -0.577  0.00  0.00    +0.096 C 
BRANCH  24  25
ATOM     25  C   LIG    1        2.669  -0.808  -1.681  0.00  0.00    +0.135 C 
ATOM     26  O   LIG    1        1.923  -1.542  -2.333  0.00  0.00    -0.297 OA
BRANCH  25  28
ATOM     27  C   LIG    1        3.995   1.021  -2.742  0.00  0.00    +0.012 C 
ATOM     28  C   LIG    1        2.744   0.678  -1.958  0.00  0.00    +0.071 C 
ENDBRANCH  25  28
ENDBRANCH  24  25
ENDBRANCH  23  24
ENDBRANCH   1  23
TORSDOF 7