@MOLECULE S-[(1S,2S)-2-methylcyclobutyl] 1-methylcyclobutanecarbothioate 31 32 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.7694 -0.9724 0.9142 C.3 1 UNL11111111 -0.2737 2 C -3.9018 -1.1953 -0.1205 C.3 1 UNL11111111 -0.2769 3 C -3.4259 0.0446 -0.9166 C.3 1 UNL11111111 -0.2750 4 C -2.2977 0.2957 0.1363 C.3 1 UNL11111111 -0.0264 5 C -2.4412 1.6030 0.8891 C.3 1 UNL11111111 -0.4494 6 C -0.9211 0.1720 -0.4545 C.2 1 UNL11111111 0.4226 7 O -0.6805 0.1804 -1.6273 O.2 1 UNL11111111 -0.4281 8 S 0.4233 0.0074 0.7629 S.3 1 UNL11111111 -0.1518 9 C 1.9073 -0.0159 -0.2938 C.3 1 UNL11111111 -0.1561 10 H 1.6860 -0.5516 -1.2345 H 1 UNL11111111 0.1730 11 C 3.1750 -0.5388 0.4496 C.3 1 UNL11111111 -0.0815 12 H 3.0316 -0.7092 1.5319 H 1 UNL11111111 0.1454 13 C 3.8102 -1.7533 -0.1948 C.3 1 UNL11111111 -0.4547 14 C 3.8869 0.8167 0.1543 C.3 1 UNL11111111 -0.2944 15 C 2.5973 1.3524 -0.5185 C.3 1 UNL11111111 -0.2764 16 H -3.1115 -0.7677 1.9319 H 1 UNL11111111 0.1482 17 H -2.0424 -1.7877 0.9648 H 1 UNL11111111 0.1522 18 H -3.8359 -2.1383 -0.6694 H 1 UNL11111111 0.1430 19 H -4.9115 -1.1122 0.2880 H 1 UNL11111111 0.1388 20 H -3.0601 -0.1721 -1.9266 H 1 UNL11111111 0.1619 21 H -4.1576 0.8511 -0.9938 H 1 UNL11111111 0.1444 22 H -3.4793 1.7615 1.2108 H 1 UNL11111111 0.1567 23 H -1.8238 1.6349 1.7968 H 1 UNL11111111 0.1632 24 H -2.1612 2.4636 0.2668 H 1 UNL11111111 0.1570 25 H 3.9964 -1.6034 -1.2651 H 1 UNL11111111 0.1512 26 H 4.7734 -1.9913 0.2729 H 1 UNL11111111 0.1493 27 H 3.1676 -2.6374 -0.0952 H 1 UNL11111111 0.1523 28 H 4.1973 1.3654 1.0456 H 1 UNL11111111 0.1410 29 H 4.7477 0.7399 -0.5132 H 1 UNL11111111 0.1444 30 H 2.7091 1.6238 -1.5731 H 1 UNL11111111 0.1479 31 H 2.1455 2.2076 -0.0071 H 1 UNL11111111 0.1521 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 1 4 1 5 4 5 1 6 4 6 1 7 6 7 2 8 6 8 1 9 8 9 1 10 9 10 1 11 9 11 1 12 11 12 1 13 11 13 1 14 11 14 1 15 14 15 1 16 9 15 1 17 1 16 1 18 1 17 1 19 2 18 1 20 2 19 1 21 3 20 1 22 3 21 1 23 5 22 1 24 5 23 1 25 5 24 1 26 13 25 1 27 13 26 1 28 13 27 1 29 14 28 1 30 14 29 1 31 15 30 1 32 15 31 1