@MOLECULE 72941889 23 24 1 SMALL USER_CHARGES @ATOM 1 Cl1 1.2880 -0.9040 1.7800 Cl 1 noname -0.0558 2 Cl2 -1.2408 0.3296 -2.7463 Cl 1 noname -0.0665 3 Cl3 3.2157 1.4547 1.3458 Cl 1 noname -0.0611 4 Cl4 2.9152 3.2508 -1.1344 Cl 1 noname -0.0724 5 Cl5 -2.7052 -3.2946 0.2219 Cl 1 noname -0.0590 6 Cl6 -5.1416 -2.3430 1.8424 Cl 1 noname -0.0711 7 O1 -0.7291 -1.2082 -0.3136 O.3 1 noname -0.1828 8 C1 0.1167 -0.1734 -0.5041 C.2 1 noname 0.0706 9 C2 -1.7981 -0.7907 0.3974 C.2 1 noname 0.0412 10 C3 1.1232 0.0808 0.4202 C.2 1 noname 0.0671 11 C4 -0.0191 0.6380 -1.6245 C.2 1 noname 0.0384 12 C5 1.9941 1.1463 0.2241 C.2 1 noname 0.0559 13 C6 0.8517 1.7035 -1.8206 C.2 1 noname 0.0200 14 C7 1.8583 1.9576 -0.8964 C.2 1 noname 0.0253 15 C8 -2.8113 -1.6861 0.7195 C.2 1 noname 0.0506 16 C9 -1.8855 0.5345 0.8074 C.2 1 noname -0.0138 17 C10 -3.9119 -1.2563 1.4515 C.2 1 noname 0.0259 18 C11 -2.9861 0.9644 1.5395 C.2 1 noname -0.0414 19 C12 -3.9993 0.0690 1.8616 C.2 1 noname -0.0275 20 H1 0.7521 2.2989 -2.6428 H 1 noname 0.0655 21 H2 -1.1420 1.1916 0.5711 H 1 noname 0.0650 22 H3 -3.0503 1.9369 1.8404 H 1 noname 0.0624 23 H4 -4.8070 0.3844 2.3988 H 1 noname 0.0638 @BOND 1 1 10 1 2 2 11 1 3 3 12 1 4 4 14 1 5 5 15 1 6 6 17 1 7 7 8 1 8 7 9 1 9 8 10 2 10 8 11 1 11 9 15 2 12 9 16 1 13 10 12 1 14 11 13 2 15 12 14 2 16 13 14 1 17 13 20 1 18 15 17 1 19 16 18 2 20 16 21 1 21 17 19 2 22 18 19 1 23 18 22 1 24 19 23 1 @SUBSTRUCTURE 1 noname 1