@MOLECULE hexachlorobutadiene 10 9 0 0 0 SMALL USER_CHARGES @ATOM 1 CL -1.1665 1.8010 1.2146 Cl 1 UNL111111111 0.0240 2 CL 1.1675 1.8013 -1.2146 Cl 1 UNL111111111 0.0241 3 CL -3.2334 -0.3070 0.0675 Cl 1 UNL111111111 0.0471 4 CL -1.1109 -1.5702 -1.3549 Cl 1 UNL111111111 0.0235 5 CL 3.2336 -0.3081 -0.0663 Cl 1 UNL111111111 0.0471 6 CL 1.1095 -1.5707 1.3540 Cl 1 UNL111111111 0.0234 7 C -0.7054 0.5526 0.1584 C.2 1 UNL111111111 -0.0739 8 C 0.7060 0.5526 -0.1590 C.2 1 UNL111111111 -0.0739 9 C -1.5931 -0.3253 -0.3114 C.2 1 UNL111111111 -0.0207 10 C 1.5930 -0.3258 0.3111 C.2 1 UNL111111111 -0.0207 @BOND 1 4 9 1 2 3 9 1 3 9 7 2 4 7 8 1 5 7 1 1 6 6 10 1 7 8 10 2 8 8 2 1 9 10 5 1