@MOLECULE S-methyl 3-methylcyclobutanecarbothioate 21 21 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.3441 1.1687 -0.3933 C.3 1 UNL11111111 -0.2765 2 C -2.6159 0.3361 -0.0490 C.3 1 UNL11111111 -0.0790 3 H -3.4487 0.9629 0.3119 H 1 UNL11111111 0.1337 4 C -3.0811 -0.5989 -1.1456 C.3 1 UNL11111111 -0.4538 5 C -1.8362 -0.3587 1.1055 C.3 1 UNL11111111 -0.2794 6 C -0.5778 0.4964 0.7829 C.3 1 UNL11111111 -0.2258 7 H -0.3196 1.1983 1.5984 H 1 UNL11111111 0.1710 8 C 0.6032 -0.3014 0.3438 C.2 1 UNL11111111 0.4221 9 O 0.6412 -1.4948 0.2504 O.2 1 UNL11111111 -0.4253 10 S 2.0568 0.7120 -0.0665 S.3 1 UNL11111111 -0.0927 11 C 3.2729 -0.5481 -0.5513 C.3 1 UNL11111111 -0.4732 12 H -0.9331 0.9723 -1.3873 H 1 UNL11111111 0.1532 13 H -1.4642 2.2495 -0.2885 H 1 UNL11111111 0.1463 14 H -2.2694 -1.2463 -1.5030 H 1 UNL11111111 0.1558 15 H -3.8849 -1.2566 -0.7921 H 1 UNL11111111 0.1487 16 H -3.4626 -0.0443 -2.0109 H 1 UNL11111111 0.1464 17 H -2.2493 -0.1950 2.1022 H 1 UNL11111111 0.1420 18 H -1.6941 -1.4378 0.9720 H 1 UNL11111111 0.1664 19 H 3.6112 -1.1346 0.3118 H 1 UNL11111111 0.1725 20 H 2.8572 -1.2520 -1.2843 H 1 UNL11111111 0.1768 21 H 4.1414 -0.0508 -0.9992 H 1 UNL11111111 0.1708 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 6 1 6 6 7 1 7 1 6 1 8 6 8 1 9 8 9 2 10 8 10 1 11 10 11 1 12 1 12 1 13 1 13 1 14 4 14 1 15 4 15 1 16 4 16 1 17 5 17 1 18 5 18 1 19 11 19 1 20 11 20 1 21 11 21 1