REMARK Name = BDB064188 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 -1.628 -0.623 0.551 0.00 0.00 +0.102 A ATOM 2 C LIG 1 -0.279 -0.938 0.461 0.00 0.00 +0.077 A ATOM 3 N LIG 1 -0.126 -1.988 1.345 0.00 0.00 -0.333 N ATOM 4 C LIG 1 1.072 -2.758 1.587 0.00 0.00 +0.150 C ATOM 5 C LIG 1 -1.332 -2.225 1.938 0.00 0.00 +0.200 A ATOM 6 N LIG 1 -2.261 -1.426 1.472 0.00 0.00 -0.235 NA ENDROOT BRANCH 2 7 ATOM 7 C LIG 1 0.786 -0.440 -0.411 0.00 0.00 +0.011 A ATOM 8 C LIG 1 1.866 0.342 0.075 0.00 0.00 +0.010 A ATOM 9 C LIG 1 2.853 0.728 -0.862 0.00 0.00 +0.074 A ATOM 10 C LIG 1 3.929 1.489 -0.435 0.00 0.00 +0.066 A ATOM 11 C LIG 1 4.047 1.884 0.891 0.00 0.00 +0.125 A ATOM 12 C LIG 1 3.090 1.534 1.827 0.00 0.00 +0.039 A ATOM 13 F LIG 1 5.099 2.620 1.269 0.00 0.00 -0.205 F ATOM 14 N LIG 1 2.793 0.394 -2.160 0.00 0.00 -0.255 NA ATOM 15 C LIG 1 1.741 -0.331 -2.590 0.00 0.00 +0.112 A ATOM 16 C LIG 1 2.000 0.767 1.422 0.00 0.00 +0.013 A ATOM 17 C LIG 1 0.726 -0.768 -1.766 0.00 0.00 +0.030 A ENDBRANCH 2 7 BRANCH 1 20 ATOM 18 C LIG 1 -4.635 -1.018 -0.434 0.00 0.00 +0.070 C ATOM 19 C LIG 1 -3.755 0.159 -0.621 0.00 0.00 +0.090 A ATOM 20 C LIG 1 -2.417 0.353 -0.188 0.00 0.00 +0.067 A ATOM 21 C LIG 1 -2.104 1.624 -0.609 0.00 0.00 +0.144 A ATOM 22 C LIG 1 -0.945 2.524 -0.478 0.00 0.00 +0.090 C ATOM 23 O LIG 1 -3.169 2.142 -1.281 0.00 0.00 -0.359 OA ATOM 24 N LIG 1 -4.204 1.228 -1.294 0.00 0.00 -0.083 NA ENDBRANCH 1 20 TORSDOF 2