@MOLECULE S-[(1R,2R)-2-methylcyclobutyl] (2R)-2-methylpentanethioate 33 33 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.9524 0.4654 -0.3531 C.3 1 UNL11111111 -0.1745 2 H -2.0372 0.4836 -1.4707 H 1 UNL11111111 0.1685 3 C -2.0166 1.8956 0.1862 C.3 1 UNL11111111 -0.4380 4 C -3.0982 -0.3916 0.2174 C.3 1 UNL11111111 -0.2724 5 C -4.4357 -0.0868 -0.4664 C.3 1 UNL11111111 -0.2491 6 C -5.5589 -0.9012 0.1749 C.3 1 UNL11111111 -0.4399 7 C -0.6367 -0.1709 0.0338 C.2 1 UNL11111111 0.4286 8 O -0.5245 -1.1250 0.7473 O.2 1 UNL11111111 -0.4319 9 S 0.8408 0.6065 -0.6941 S.3 1 UNL11111111 -0.1542 10 C 2.1892 -0.3433 0.0806 C.3 1 UNL11111111 -0.1583 11 H 1.9539 -1.4212 0.0363 H 1 UNL11111111 0.1711 12 C 3.5926 0.0264 -0.4894 C.3 1 UNL11111111 -0.0834 13 H 3.5911 0.8851 -1.1857 H 1 UNL11111111 0.1453 14 C 4.3397 -1.1432 -1.0969 C.3 1 UNL11111111 -0.4541 15 C 4.0503 0.4319 0.9450 C.3 1 UNL11111111 -0.2925 16 C 2.6315 0.1257 1.4889 C.3 1 UNL11111111 -0.2764 17 H -1.8109 1.9351 1.2630 H 1 UNL11111111 0.1539 18 H -1.3064 2.5650 -0.3133 H 1 UNL11111111 0.1586 19 H -3.0147 2.3249 0.0348 H 1 UNL11111111 0.1532 20 H -2.8606 -1.4694 0.1018 H 1 UNL11111111 0.1565 21 H -3.1787 -0.2324 1.3099 H 1 UNL11111111 0.1510 22 H -4.6689 0.9924 -0.3975 H 1 UNL11111111 0.1334 23 H -4.3728 -0.3152 -1.5472 H 1 UNL11111111 0.1338 24 H -6.5193 -0.7131 -0.3157 H 1 UNL11111111 0.1401 25 H -5.3618 -1.9779 0.1098 H 1 UNL11111111 0.1462 26 H -5.6775 -0.6539 1.2367 H 1 UNL11111111 0.1441 27 H 3.8611 -1.4818 -2.0247 H 1 UNL11111111 0.1519 28 H 5.3736 -0.8683 -1.3405 H 1 UNL11111111 0.1500 29 H 4.3808 -2.0033 -0.4176 H 1 UNL11111111 0.1514 30 H 4.8410 -0.1954 1.3625 H 1 UNL11111111 0.1449 31 H 4.3585 1.4748 1.0404 H 1 UNL11111111 0.1414 32 H 2.1066 0.9963 1.8923 H 1 UNL11111111 0.1514 33 H 2.5907 -0.6610 2.2492 H 1 UNL11111111 0.1494 @BOND 1 1 2 1 2 1 3 1 3 1 4 1 4 4 5 1 5 5 6 1 6 1 7 1 7 7 8 2 8 7 9 1 9 9 10 1 10 10 11 1 11 10 12 1 12 12 13 1 13 12 14 1 14 12 15 1 15 15 16 1 16 10 16 1 17 3 17 1 18 3 18 1 19 3 19 1 20 4 20 1 21 4 21 1 22 5 22 1 23 5 23 1 24 6 24 1 25 6 25 1 26 6 26 1 27 14 27 1 28 14 28 1 29 14 29 1 30 15 30 1 31 15 31 1 32 16 32 1 33 16 33 1