@MOLECULE 72941870 23 24 1 SMALL USER_CHARGES @ATOM 1 Cl1 0.6869 2.6882 -3.1805 Cl 1 noname -0.0693 2 Cl2 3.2157 1.4547 1.3458 Cl 1 noname -0.0693 3 Cl3 2.9152 3.2508 -1.1344 Cl 1 noname -0.0651 4 Cl4 -5.1416 -2.3430 1.8424 Cl 1 noname -0.0819 5 O1 -0.7291 -1.2082 -0.3136 O.3 1 noname -0.2016 6 C1 0.1167 -0.1734 -0.5041 C.2 1 noname 0.0231 7 C2 -1.7981 -0.7907 0.3974 C.2 1 noname 0.0137 8 C3 1.1232 0.0808 0.4202 C.2 1 noname 0.0174 9 C4 -0.0191 0.6380 -1.6245 C.2 1 noname 0.0174 10 C5 0.8517 1.7035 -1.8206 C.2 1 noname 0.0369 11 C6 1.9941 1.1463 0.2241 C.2 1 noname 0.0369 12 C7 -2.8113 -1.6861 0.7195 C.2 1 noname 0.0090 13 C8 -1.8855 0.5345 0.8074 C.2 1 noname -0.0206 14 C9 1.8583 1.9576 -0.8964 C.2 1 noname 0.0391 15 C10 -3.9119 -1.2563 1.4515 C.2 1 noname -0.0020 16 C11 -2.9861 0.9644 1.5395 C.2 1 noname -0.0404 17 C12 -3.9993 0.0690 1.8616 C.2 1 noname -0.0343 18 H1 1.2229 -0.5146 1.2424 H 1 noname 0.0666 19 H2 -0.7578 0.4515 -2.3027 H 1 noname 0.0666 20 H3 -2.7471 -2.6586 0.4186 H 1 noname 0.0665 21 H4 -1.1420 1.1916 0.5711 H 1 noname 0.0650 22 H5 -3.0503 1.9369 1.8404 H 1 noname 0.0624 23 H6 -4.8070 0.3844 2.3988 H 1 noname 0.0638 @BOND 1 1 10 1 2 2 11 1 3 3 14 1 4 4 15 1 5 5 6 1 6 5 7 1 7 6 8 2 8 6 9 1 9 7 12 2 10 7 13 1 11 8 11 1 12 8 18 1 13 9 10 2 14 9 19 1 15 10 14 1 16 11 14 2 17 12 15 1 18 12 20 1 19 13 16 2 20 13 21 1 21 15 17 2 22 16 17 1 23 16 22 1 24 17 23 1 @SUBSTRUCTURE 1 noname 1