@MOLECULE 5-chloro-3-{2-[4-(2-hydroxyethyl)-4-oxido-1-piperazinyl]-2-oxoethyl}-1,3-benzothiazol-2(3h)-one 24 24 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O -7.1055 1.1909 -2.1921 O.2 1 UNL1 -0.4224 2 C -6.7061 1.1853 -1.1259 C.2 1 UNL1 0.4275 3 C -5.1603 2.1667 0.7082 C.2 2 UNL2 0.4538 4 N -5.1550 -1.4027 -0.4581 N.1 1 UNL1 -0.1544 5 O -4.6812 1.3914 1.3949 O.2 2 UNL2 -0.4592 6 C -4.0132 -1.3509 -0.2688 C.1 1 UNL1 0.1330 7 C -2.6450 -1.2789 -0.0610 C.3 1 UNL1 0.0400 8 N -1.7463 -1.2792 0.9339 N.pl3 1 UNL1 0.2662 9 C -1.7008 -1.3833 2.2021 C.1 1 UNL1 -0.7180 10 C -1.6649 -1.4698 3.4773 C.1 1 UNL1 0.4339 11 C -0.6781 -1.1422 -0.0884 C.3 1 UNL1 0.2410 12 O -1.6572 -1.1341 -1.1048 O.3 1 UNL1 -0.1636 13 C 0.6159 -1.1048 -0.1386 C.3 1 UNL1 0.0369 14 N 1.8749 -1.0619 -0.1932 N.ar 1 UNL1 -0.0023 15 C 2.7218 -2.3553 -0.3357 C.ar 1 UNL1 0.4155 16 O 2.1346 -3.3784 -0.3185 O.2 1 UNL1 -0.2913 17 S 4.4389 -1.9149 -0.5060 S.2 1 UNL1 0.2887 18 C 4.0980 -0.2149 -0.3570 C.ar 1 UNL1 -0.1265 19 C 4.8004 0.9168 -0.3362 C.ar 1 UNL1 -0.1530 20 C 4.2941 2.0907 -0.1748 C.ar 1 UNL1 0.0426 21 C 3.0197 2.5037 0.0036 C.ar 1 UNL1 -0.0003 22 CL 2.4601 4.0714 0.2248 Cl 1 UNL1 -0.0072 23 C 2.1786 1.3736 -0.0124 C.ar 1 UNL1 -0.1592 24 C 2.6566 0.0940 -0.1767 C.ar 1 UNL1 -0.1217 @BOND 1 1 2 2 2 12 11 1 3 12 7 1 4 17 18 ar 5 17 15 ar 6 4 6 3 7 18 19 ar 8 18 24 ar 9 19 20 ar 10 15 16 2 11 15 14 ar 12 6 7 1 13 14 24 ar 14 14 13 1 15 24 23 ar 16 20 21 ar 17 13 11 1 18 11 8 1 19 7 8 1 20 23 21 ar 21 21 22 1 22 3 5 2 23 8 9 1 24 9 10 3