REMARK  Name = BDB035148
REMARK                            x       y       z     vdW  Elec       q    Type
REMARK                         _______ _______ _______ _____ _____    ______ ____
ROOT
ATOM      1  N   LIG    1       -0.488   1.085   3.140  0.00  0.00    -0.296 NA
ATOM      2  C   LIG    1       -0.180   2.152   2.180  0.00  0.00    +0.100 C 
ATOM      3  C   LIG    1        1.296   2.101   1.724  0.00  0.00    +0.100 C 
ATOM      4  N   LIG    1        1.604   0.881   0.946  0.00  0.00    -0.292 NA
ATOM      5  C   LIG    1        0.846  -0.283   1.475  0.00  0.00    +0.100 C 
ATOM      6  C   LIG    1        0.310  -0.126   2.918  0.00  0.00    +0.100 C 
ENDROOT
BRANCH   4   7
ATOM      7  C   LIG    1        3.058   0.616   0.828  0.00  0.00    +0.102 C 
ATOM      8  C   LIG    1        3.931   1.859   0.571  0.00  0.00    +0.054 C 
ATOM      9  C   LIG    1        5.282   1.478   0.061  0.00  0.00    +0.006 C 
ATOM     10  C   LIG    1        5.452   0.344  -0.635  0.00  0.00    +0.104 C 
ATOM     11  N   LIG    1        4.424  -0.509  -0.968  0.00  0.00    -0.255 NA
ATOM     12  C   LIG    1        3.302  -0.360  -0.323  0.00  0.00    +0.103 C 
BRANCH  10  13
ATOM     13  C   LIG    1        6.743   0.009  -1.121  0.00  0.00    +0.180 A 
ATOM     14  N   LIG    1        6.879  -1.086  -1.934  0.00  0.00    -0.324 N 
ATOM     15  H   LIG    1        6.117  -1.682  -2.223  0.00  0.00    +0.169 HD
ATOM     16  C   LIG    1        8.203  -1.179  -2.254  0.00  0.00    +0.128 A 
ATOM     17  C   LIG    1        8.754  -2.237  -3.123  0.00  0.00    +0.088 C 
ATOM     18  N   LIG    1        8.851  -0.196  -1.668  0.00  0.00    -0.134 NA
ATOM     19  N   LIG    1        7.936   0.552  -0.959  0.00  0.00    -0.128 NA
ENDBRANCH  10  13
ENDBRANCH   4   7
BRANCH   1  20
ATOM     20  C   LIG    1       -1.915   0.877   3.394  0.00  0.00    +0.121 C 
BRANCH  20  30
ATOM     21  C   LIG    1       -6.018  -0.782  -1.388  0.00  0.00    +0.081 C 
ATOM     22  C   LIG    1       -5.524   0.640  -1.662  0.00  0.00    +0.221 C 
ATOM     23  O   LIG    1       -5.909   1.333  -2.600  0.00  0.00    -0.275 OA
ATOM     24  N   LIG    1       -4.676   1.173  -0.721  0.00  0.00    -0.284 N 
ATOM     25  H   LIG    1       -4.462   2.156  -0.825  0.00  0.00    +0.155 HD
ATOM     26  C   LIG    1       -4.069   0.419   0.287  0.00  0.00    +0.055 A 
ATOM     27  C   LIG    1       -4.170  -0.970   0.284  0.00  0.00    +0.063 A 
ATOM     28  N   LIG    1       -3.599  -1.752   1.228  0.00  0.00    -0.258 NA
ATOM     29  C   LIG    1       -2.906  -1.121   2.204  0.00  0.00    +0.116 A 
ATOM     30  C   LIG    1       -2.723   0.259   2.279  0.00  0.00    -0.014 A 
ATOM     31  C   LIG    1       -3.332   1.039   1.290  0.00  0.00    +0.031 A 
ATOM     32  C   LIG    1       -4.857  -1.640  -0.874  0.00  0.00    +0.070 C 
BRANCH  21  34
ATOM     33  C   LIG    1       -8.072  -0.940  -2.893  0.00  0.00    +0.004 C 
ATOM     34  C   LIG    1       -6.654  -1.433  -2.627  0.00  0.00    +0.010 C 
ENDBRANCH  21  34
ENDBRANCH  20  30
ENDBRANCH   1  20
TORSDOF 5