@MOLECULE 1-isopropylsulfanyl-1-methyl-cyclobutane 25 25 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.9156 -0.1277 0.2962 C.3 1 UNL11111111 -0.0781 2 C -3.1935 0.5434 -0.1929 C.3 1 UNL11111111 -0.4482 3 C -1.9334 -1.6226 0.0095 C.3 1 UNL11111111 -0.4581 4 S -0.5052 0.7147 -0.5737 S.3 1 UNL11111111 -0.1422 5 C 1.0058 0.1930 0.3345 C.3 1 UNL11111111 0.0462 6 C 0.8971 0.4173 1.8244 C.3 1 UNL11111111 -0.4675 7 C 1.5457 -1.2123 -0.0649 C.3 1 UNL11111111 -0.3010 8 C 2.7970 -0.5533 -0.7006 C.3 1 UNL11111111 -0.2691 9 C 2.2577 0.8502 -0.3228 C.3 1 UNL11111111 -0.2869 10 H -1.7948 0.0472 1.3902 H 1 UNL11111111 0.1424 11 H -4.0706 0.1263 0.3199 H 1 UNL11111111 0.1488 12 H -3.1977 1.6253 -0.0021 H 1 UNL11111111 0.1565 13 H -3.3570 0.4002 -1.2697 H 1 UNL11111111 0.1574 14 H -2.8041 -2.1001 0.4790 H 1 UNL11111111 0.1498 15 H -1.9928 -1.8396 -1.0658 H 1 UNL11111111 0.1592 16 H -1.0426 -2.1317 0.3972 H 1 UNL11111111 0.1475 17 H 0.1722 -0.2565 2.2983 H 1 UNL11111111 0.1496 18 H 1.8617 0.2372 2.3222 H 1 UNL11111111 0.1567 19 H 0.6063 1.4485 2.0702 H 1 UNL11111111 0.1615 20 H 1.7581 -1.8679 0.7829 H 1 UNL11111111 0.1419 21 H 0.9308 -1.7732 -0.7744 H 1 UNL11111111 0.1524 22 H 3.7427 -0.8199 -0.2244 H 1 UNL11111111 0.1378 23 H 2.8968 -0.7231 -1.7759 H 1 UNL11111111 0.1433 24 H 2.0670 1.5051 -1.1787 H 1 UNL11111111 0.1548 25 H 2.8855 1.4080 0.3775 H 1 UNL11111111 0.1454 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 5 7 1 7 7 8 1 8 8 9 1 9 5 9 1 10 1 10 1 11 2 11 1 12 2 12 1 13 2 13 1 14 3 14 1 15 3 15 1 16 3 16 1 17 6 17 1 18 6 18 1 19 6 19 1 20 7 20 1 21 7 21 1 22 8 22 1 23 8 23 1 24 9 24 1 25 9 25 1