@MOLECULE 71402176 23 24 1 SMALL USER_CHARGES @ATOM 1 Cl1 -3.0922 2.5728 2.0371 Cl 1 noname -0.0693 2 Cl2 0.6869 2.6882 -3.1805 Cl 1 noname -0.0693 3 Cl3 -5.1416 -2.3430 1.8424 Cl 1 noname -0.0693 4 Cl4 3.2157 1.4547 1.3458 Cl 1 noname -0.0693 5 Cl5 -5.3352 0.5907 2.7500 Cl 1 noname -0.0651 6 Cl6 2.9152 3.2508 -1.1344 Cl 1 noname -0.0651 7 O1 -0.7291 -1.2082 -0.3136 O.3 1 noname -0.2008 8 C1 0.1167 -0.1734 -0.5041 C.2 1 noname 0.0232 9 C2 -1.7981 -0.7907 0.3974 C.2 1 noname 0.0232 10 C3 -2.8113 -1.6861 0.7195 C.2 1 noname 0.0174 11 C4 1.1232 0.0808 0.4202 C.2 1 noname 0.0174 12 C5 -1.8855 0.5345 0.8074 C.2 1 noname 0.0174 13 C6 -0.0191 0.6380 -1.6245 C.2 1 noname 0.0174 14 C7 0.8517 1.7035 -1.8206 C.2 1 noname 0.0369 15 C8 -2.9861 0.9644 1.5395 C.2 1 noname 0.0369 16 C9 1.9941 1.1463 0.2241 C.2 1 noname 0.0369 17 C10 -3.9119 -1.2563 1.4515 C.2 1 noname 0.0369 18 C11 1.8583 1.9576 -0.8964 C.2 1 noname 0.0391 19 C12 -3.9993 0.0690 1.8616 C.2 1 noname 0.0391 20 H1 1.2229 -0.5146 1.2424 H 1 noname 0.0666 21 H2 -2.7471 -2.6586 0.4186 H 1 noname 0.0666 22 H3 -0.7578 0.4515 -2.3027 H 1 noname 0.0666 23 H4 -1.1420 1.1916 0.5711 H 1 noname 0.0666 @BOND 1 1 15 1 2 2 14 1 3 3 17 1 4 4 16 1 5 5 19 1 6 6 18 1 7 7 8 1 8 7 9 1 9 8 11 2 10 8 13 1 11 9 10 2 12 9 12 1 13 10 17 1 14 10 21 1 15 11 16 1 16 11 20 1 17 12 15 2 18 12 23 1 19 13 14 2 20 13 22 1 21 14 18 1 22 15 19 1 23 16 18 2 24 17 19 2 @SUBSTRUCTURE 1 noname 1