@MOLECULE 85364152 22 24 1 SMALL USER_CHARGES @ATOM 1 Cl1 4.0977 1.4098 0.3250 Cl 1 noname -0.1092 2 Cl2 -0.6093 0.8789 3.1552 Cl 1 noname -0.1089 3 Cl3 1.8820 3.0255 2.3753 Cl 1 noname -0.0968 4 Cl4 2.8732 0.5288 3.5360 Cl 1 noname -0.0968 5 Cl5 2.9596 -2.0476 -1.5008 Cl 1 noname -0.1179 6 Cl6 1.6809 2.5651 -1.3004 Cl 1 noname -0.0708 7 Cl7 -1.1856 2.1435 0.3139 Cl 1 noname -0.0708 8 C1 2.2214 -0.6140 0.7505 C.3 1 noname 0.0145 9 C2 1.0161 -0.7756 1.6897 C.3 1 noname 0.0108 10 C3 2.4680 0.9269 0.7941 C.3 1 noname 0.1213 11 C4 0.6069 0.7045 1.9054 C.3 1 noname 0.1227 12 C5 1.9945 1.2797 2.2126 C.3 1 noname 0.1667 13 C6 1.7327 -1.1343 -0.6193 C.3 1 noname 0.0572 14 C7 1.4506 1.6785 0.0803 C.2 1 noname 0.0442 15 C8 0.2932 1.5273 0.7368 C.2 1 noname 0.0443 16 C9 0.1165 -1.6171 0.9532 C.2 1 noname -0.0773 17 C10 0.5398 -1.8505 -0.2866 C.2 1 noname -0.0739 18 H1 3.0562 -1.2020 1.1320 H 1 noname 0.0351 19 H2 1.3066 -1.2646 2.6319 H 1 noname 0.0373 20 H3 1.4178 -0.3010 -1.2474 H 1 noname 0.0519 21 H4 -0.7247 -1.9828 1.3257 H 1 noname 0.0576 22 H5 0.0760 -2.4585 -0.9154 H 1 noname 0.0588 @BOND 1 10 1 1 2 11 2 1 3 3 12 1 4 4 12 1 5 13 5 1 6 6 14 1 7 7 15 1 8 8 9 1 9 8 10 1 10 8 13 1 11 8 18 1 12 9 11 1 13 9 16 1 14 9 19 1 15 10 12 1 16 10 14 1 17 11 12 1 18 11 15 1 19 13 17 1 20 13 20 1 21 14 15 2 22 16 17 2 23 16 21 1 24 17 22 1 @SUBSTRUCTURE 1 noname 1