@MOLECULE S-propyl (1R,2S)-2-methylcyclobutanecarbothioate 27 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.5646 0.9214 0.2149 C.3 1 UNL11111111 -0.0541 2 H -2.8633 1.5563 1.0682 H 1 UNL11111111 0.1382 3 C -1.9395 1.7595 -0.8791 C.3 1 UNL11111111 -0.4659 4 C -3.7073 -0.0197 -0.2692 C.3 1 UNL11111111 -0.2945 5 C -2.8893 -1.2563 0.1729 C.3 1 UNL11111111 -0.2576 6 C -1.7501 -0.3348 0.6964 C.3 1 UNL11111111 -0.2482 7 H -1.6536 -0.3705 1.7981 H 1 UNL11111111 0.1699 8 C -0.4452 -0.5341 0.0086 C.2 1 UNL11111111 0.4434 9 O -0.2769 -1.1335 -1.0152 O.2 1 UNL11111111 -0.4347 10 S 0.9667 0.2241 0.8707 S.3 1 UNL11111111 -0.1480 11 C 2.3503 -0.1958 -0.2672 C.3 1 UNL11111111 -0.2876 12 C 3.6634 0.3158 0.3148 C.3 1 UNL11111111 -0.2467 13 C 4.8173 -0.0287 -0.6306 C.3 1 UNL11111111 -0.4381 14 H -2.6625 2.4807 -1.2814 H 1 UNL11111111 0.1519 15 H -1.0789 2.3342 -0.5135 H 1 UNL11111111 0.1572 16 H -1.5934 1.1478 -1.7242 H 1 UNL11111111 0.1611 17 H -4.6550 0.1137 0.2567 H 1 UNL11111111 0.1390 18 H -3.9079 0.0280 -1.3429 H 1 UNL11111111 0.1488 19 H -3.3595 -1.8705 0.9442 H 1 UNL11111111 0.1412 20 H -2.5896 -1.9151 -0.6515 H 1 UNL11111111 0.1624 21 H 2.3779 -1.2920 -0.4190 H 1 UNL11111111 0.1678 22 H 2.1525 0.2466 -1.2616 H 1 UNL11111111 0.1644 23 H 3.6309 1.4130 0.4726 H 1 UNL11111111 0.1453 24 H 3.8585 -0.1285 1.3122 H 1 UNL11111111 0.1461 25 H 4.9000 -1.1103 -0.7887 H 1 UNL11111111 0.1471 26 H 4.6879 0.4400 -1.6130 H 1 UNL11111111 0.1464 27 H 5.7753 0.3173 -0.2258 H 1 UNL11111111 0.1449 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 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 11 12 1 13 12 13 1 14 3 14 1 15 3 15 1 16 3 16 1 17 4 17 1 18 4 18 1 19 5 19 1 20 5 20 1 21 11 21 1 22 11 22 1 23 12 23 1 24 12 24 1 25 13 25 1 26 13 26 1 27 13 27 1