@MOLECULE S-[(1S,2R)-2-methylcyclobutyl] propanethioate 24 24 0 0 0 SMALL USER_CHARGES @ATOM 1 C 4.1445 -0.2299 0.2095 C.3 1 UNL11111111 -0.4192 2 C 2.9291 0.6911 0.2883 C.3 1 UNL11111111 -0.3422 3 C 1.7128 -0.0202 -0.2233 C.2 1 UNL11111111 0.4436 4 O 1.7220 -0.9412 -0.9878 O.2 1 UNL11111111 -0.4302 5 S 0.1464 0.6592 0.4092 S.3 1 UNL11111111 -0.1482 6 C -1.0918 -0.4661 -0.3083 C.3 1 UNL11111111 -0.1686 7 H -0.6497 -0.9826 -1.1827 H 1 UNL11111111 0.1740 8 C -2.4931 0.1498 -0.6274 C.3 1 UNL11111111 -0.0775 9 H -2.7853 -0.0666 -1.6737 H 1 UNL11111111 0.1390 10 C -2.7361 1.6112 -0.3200 C.3 1 UNL11111111 -0.4530 11 C -3.1405 -0.8427 0.3863 C.3 1 UNL11111111 -0.2944 12 C -1.7468 -1.4381 0.7050 C.3 1 UNL11111111 -0.2775 13 H 5.0499 0.2700 0.5704 H 1 UNL11111111 0.1452 14 H 4.0021 -1.1377 0.8100 H 1 UNL11111111 0.1535 15 H 4.3315 -0.5584 -0.8227 H 1 UNL11111111 0.1611 16 H 2.7966 1.0541 1.3297 H 1 UNL11111111 0.1739 17 H 3.1014 1.6064 -0.3228 H 1 UNL11111111 0.1763 18 H -2.1155 2.2676 -0.9439 H 1 UNL11111111 0.1560 19 H -3.7833 1.8791 -0.5112 H 1 UNL11111111 0.1470 20 H -2.5333 1.8635 0.7281 H 1 UNL11111111 0.1548 21 H -3.6307 -0.3630 1.2367 H 1 UNL11111111 0.1453 22 H -3.8475 -1.5455 -0.0585 H 1 UNL11111111 0.1410 23 H -1.6294 -2.4949 0.4444 H 1 UNL11111111 0.1469 24 H -1.4379 -1.3237 1.7486 H 1 UNL11111111 0.1530 @BOND 1 1 2 1 2 2 3 1 3 3 4 2 4 3 5 1 5 5 6 1 6 6 7 1 7 6 8 1 8 8 9 1 9 8 10 1 10 8 11 1 11 11 12 1 12 6 12 1 13 1 13 1 14 1 14 1 15 1 15 1 16 2 16 1 17 2 17 1 18 10 18 1 19 10 19 1 20 10 20 1 21 11 21 1 22 11 22 1 23 12 23 1 24 12 24 1