@MOLECULE 1-ethylsulfanyl-1-methyl-cyclobutane 22 22 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.3312 -0.4467 0.2297 C.3 1 UNL11111111 -0.4293 2 C 1.9977 0.1881 0.5834 C.3 1 UNL11111111 -0.2827 3 S 0.7884 -0.1768 -0.7602 S.3 1 UNL11111111 -0.1023 4 C -0.8075 0.3711 -0.0291 C.3 1 UNL11111111 0.0384 5 C -0.8290 1.8609 0.2202 C.3 1 UNL11111111 -0.4650 6 C -1.9967 -0.1598 -0.8833 C.3 1 UNL11111111 -0.2868 7 C -2.4806 -1.0107 0.3193 C.3 1 UNL11111111 -0.2673 8 C -1.2946 -0.4906 1.1728 C.3 1 UNL11111111 -0.3019 9 H 4.0752 -0.2506 1.0139 H 1 UNL11111111 0.1471 10 H 3.2613 -1.5381 0.1218 H 1 UNL11111111 0.1557 11 H 3.7466 -0.0526 -0.7080 H 1 UNL11111111 0.1549 12 H 1.6142 -0.2036 1.5421 H 1 UNL11111111 0.1482 13 H 2.0992 1.2822 0.6964 H 1 UNL11111111 0.1494 14 H -0.6320 2.4362 -0.6960 H 1 UNL11111111 0.1621 15 H -1.8107 2.1882 0.5922 H 1 UNL11111111 0.1551 16 H -0.0898 2.1726 0.9686 H 1 UNL11111111 0.1493 17 H -2.6956 0.6183 -1.2026 H 1 UNL11111111 0.1459 18 H -1.7320 -0.7419 -1.7712 H 1 UNL11111111 0.1543 19 H -3.4673 -0.7389 0.7000 H 1 UNL11111111 0.1382 20 H -2.4679 -2.0891 0.1415 H 1 UNL11111111 0.1435 21 H -0.6089 -1.2717 1.5101 H 1 UNL11111111 0.1495 22 H -1.5891 0.0919 2.0498 H 1 UNL11111111 0.1435 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 4 6 1 6 6 7 1 7 7 8 1 8 4 8 1 9 1 9 1 10 1 10 1 11 1 11 1 12 2 12 1 13 2 13 1 14 5 14 1 15 5 15 1 16 5 16 1 17 6 17 1 18 6 18 1 19 7 19 1 20 7 20 1 21 8 21 1 22 8 22 1