REMARK Name = BDB001632 REMARK x y z vdW Elec q Type REMARK _______ _______ _______ _____ _____ ______ ____ ROOT ATOM 1 C LIG 1 1.629 1.131 -0.830 0.00 0.00 +0.071 A ATOM 2 C LIG 1 0.461 1.474 -1.528 0.00 0.00 +0.055 A ATOM 3 C LIG 1 0.407 2.673 -2.257 0.00 0.00 +0.014 A ATOM 4 C LIG 1 1.499 3.540 -2.263 0.00 0.00 +0.001 A ATOM 5 C LIG 1 2.653 3.213 -1.553 0.00 0.00 +0.001 A ATOM 6 C LIG 1 2.723 2.012 -0.845 0.00 0.00 +0.016 A ENDROOT BRANCH 2 7 ATOM 7 C LIG 1 -0.757 0.628 -1.540 0.00 0.00 +0.281 C ATOM 8 N LIG 1 -1.424 0.208 -0.377 0.00 0.00 -0.176 N ATOM 9 C LIG 1 -2.521 -0.622 -0.231 0.00 0.00 +0.098 A ATOM 10 C LIG 1 -2.746 -0.623 1.140 0.00 0.00 +0.113 A ATOM 11 C LIG 1 -3.799 -1.381 1.671 0.00 0.00 +0.032 A ATOM 12 C LIG 1 -4.602 -2.120 0.794 0.00 0.00 +0.002 A ATOM 13 C LIG 1 -4.359 -2.106 -0.581 0.00 0.00 +0.002 A ATOM 14 N LIG 1 -1.831 0.179 1.762 0.00 0.00 -0.129 NA ATOM 15 C LIG 1 -3.311 -1.356 -1.127 0.00 0.00 +0.030 A ATOM 16 N LIG 1 -1.037 0.695 0.835 0.00 0.00 -0.057 NA ATOM 17 O LIG 1 -1.247 0.339 -2.632 0.00 0.00 -0.265 OA ENDBRANCH 2 7 BRANCH 1 18 ATOM 18 C LIG 1 1.750 -0.181 -0.153 0.00 0.00 +0.341 C ATOM 19 O LIG 1 1.173 -1.183 -0.541 0.00 0.00 -0.245 OA BRANCH 18 20 ATOM 20 O LIG 1 2.541 -0.065 0.937 0.00 0.00 -0.448 OA BRANCH 20 21 ATOM 21 C LIG 1 2.699 -1.257 1.716 0.00 0.00 +0.320 C BRANCH 21 23 ATOM 22 C LIG 1 5.022 -2.421 1.105 0.00 0.00 +0.007 C ATOM 23 C LIG 1 3.977 -1.897 1.381 0.00 0.00 -0.065 C ENDBRANCH 21 23 ENDBRANCH 20 21 ENDBRANCH 18 20 ENDBRANCH 1 18 TORSDOF 5