REMARK  Name = BDB016409
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.588  -0.317   0.300  0.00  0.00    -0.313 N 
ATOM      2  H   LIG    1       -0.687   0.103  -0.624  0.00  0.00    +0.152 HD
ENDROOT
BRANCH   1   3
ATOM      3  C   LIG    1       -1.642   0.164   1.131  0.00  0.00    +0.054 A 
ATOM      4  C   LIG    1       -2.954   0.240   0.550  0.00  0.00    +0.070 A 
ATOM      5  N   LIG    1       -3.011  -0.106  -0.809  0.00  0.00    -0.338 N 
ATOM      6  H   LIG    1       -2.478  -0.965  -0.956  0.00  0.00    +0.146 HD
ATOM      7  C   LIG    1       -4.183   0.009  -1.656  0.00  0.00    +0.076 C 
ATOM      8  C   LIG    1       -5.407  -0.605  -1.021  0.00  0.00    +0.118 C 
ATOM      9  C   LIG    1       -6.066   0.317  -0.047  0.00  0.00    +0.219 C 
ATOM     10  N   LIG    1       -5.360   0.857   0.977  0.00  0.00    -0.284 N 
ATOM     11  H   LIG    1       -5.968   1.362   1.611  0.00  0.00    +0.155 HD
ATOM     12  O   LIG    1       -7.274   0.555  -0.123  0.00  0.00    -0.275 OA
ATOM     13  C   LIG    1       -4.351   1.441  -2.162  0.00  0.00    +0.028 C 
ATOM     14  C   LIG    1       -4.005   0.745   1.342  0.00  0.00    +0.056 A 
ATOM     15  C   LIG    1       -3.734   1.170   2.657  0.00  0.00    +0.025 A 
ATOM     16  C   LIG    1       -2.462   1.068   3.213  0.00  0.00    +0.004 A 
ATOM     17  C   LIG    1       -1.420   0.555   2.455  0.00  0.00    +0.025 A 
ENDBRANCH   1   3
BRANCH   1  20
ATOM     18  C   LIG    1        3.081  -0.881   0.036  0.00  0.00    -0.014 A 
ATOM     19  C   LIG    1        1.772  -0.453  -0.240  0.00  0.00    +0.031 A 
ATOM     20  C   LIG    1        0.704  -0.771   0.612  0.00  0.00    +0.032 A 
ATOM     21  C   LIG    1        0.967  -1.549   1.744  0.00  0.00    +0.023 A 
ATOM     22  C   LIG    1        2.261  -1.987   2.030  0.00  0.00    +0.002 A 
ATOM     23  C   LIG    1        3.315  -1.653   1.181  0.00  0.00    +0.009 A 
BRANCH  18  25
ATOM     24  C   LIG    1        5.309   0.040  -0.444  0.00  0.00    +0.077 C 
ATOM     25  C   LIG    1        4.176  -0.534  -0.889  0.00  0.00    +0.013 C 
BRANCH  24  27
ATOM     26  C   LIG    1        7.713   0.705  -0.515  0.00  0.00    +0.125 C 
ATOM     27  N   LIG    1        6.452   0.368  -1.146  0.00  0.00    -0.352 N 
ATOM     28  H   LIG    1        6.550  -0.132  -2.033  0.00  0.00    +0.145 HD
ENDBRANCH  24  27
BRANCH  25  29
ATOM     29  C   LIG    1        4.036  -0.855  -2.338  0.00  0.00    +0.111 C 
ATOM     30  N   LIG    1        4.489  -0.146  -3.319  0.00  0.00    -0.307 NA
ATOM     31  H   LIG    1        4.944   0.697  -2.934  0.00  0.00    +0.186 HD
ENDBRANCH  25  29
ENDBRANCH  18  25
ENDBRANCH   1  20
TORSDOF 5