REMARK Name = BDB018855 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 1.321 0.206 0.332 0.00 0.00 +0.115 A ATOM 2 N LIG 1 0.374 0.783 1.089 0.00 0.00 -0.076 NA ATOM 3 O LIG 1 -0.812 0.167 0.772 0.00 0.00 -0.339 OA ATOM 4 C LIG 1 -0.617 -0.767 -0.193 0.00 0.00 +0.227 A ATOM 5 C LIG 1 0.727 -0.794 -0.488 0.00 0.00 +0.097 A ENDROOT BRANCH 1 8 ATOM 6 C LIG 1 5.049 0.399 -0.327 0.00 0.00 +0.121 A ATOM 7 C LIG 1 3.704 0.015 -0.403 0.00 0.00 +0.055 A ATOM 8 C LIG 1 2.729 0.609 0.413 0.00 0.00 +0.007 A ATOM 9 C LIG 1 3.136 1.605 1.314 0.00 0.00 +0.010 A ATOM 10 C LIG 1 4.475 1.992 1.394 0.00 0.00 +0.004 A ATOM 11 C LIG 1 5.431 1.389 0.575 0.00 0.00 +0.045 A BRANCH 6 13 ATOM 12 C LIG 1 7.255 0.084 -1.157 0.00 0.00 +0.277 C ATOM 13 O LIG 1 5.878 -0.271 -1.185 0.00 0.00 -0.495 OA ENDBRANCH 6 13 ENDBRANCH 1 8 BRANCH 4 14 ATOM 14 N LIG 1 -1.675 -1.543 -0.656 0.00 0.00 -0.242 N ATOM 15 C LIG 1 -3.000 -1.325 -0.271 0.00 0.00 +0.243 C ATOM 16 O LIG 1 -3.830 -2.245 -0.324 0.00 0.00 -0.273 OA ATOM 17 C LIG 1 -1.404 -2.764 -1.408 0.00 0.00 +0.141 C BRANCH 15 18 ATOM 18 C LIG 1 -3.465 0.083 0.158 0.00 0.00 +0.170 C ATOM 19 N LIG 1 -4.786 0.434 -0.490 0.00 0.00 -0.258 N ATOM 20 C LIG 1 -5.810 0.561 0.569 0.00 0.00 +0.117 C ATOM 21 C LIG 1 -5.007 0.958 1.794 0.00 0.00 +0.022 C ATOM 22 C LIG 1 -3.750 0.119 1.665 0.00 0.00 +0.034 C BRANCH 19 23 ATOM 23 C LIG 1 -5.052 0.280 -1.793 0.00 0.00 +0.170 C ATOM 24 N LIG 1 -5.261 0.163 -2.925 0.00 0.00 -0.174 NA ENDBRANCH 19 23 ENDBRANCH 15 18 ENDBRANCH 4 14 TORSDOF 5