@MOLECULE (1S,2S)-1-[(S)-ethylsulfinyl]-2-methyl-cyclopropane 20 20 0 0 0 SMALL USER_CHARGES @ATOM 1 C 3.2807 -0.4479 -0.0611 C.3 1 UNL11111111 -0.4186 2 C 1.8305 -0.8901 0.0270 C.3 1 UNL11111111 -0.4718 3 S 0.7138 0.5000 -0.4460 S.O 1 UNL11111111 1.0912 4 O 0.6643 1.4099 0.7266 O.2 1 UNL11111111 -0.8018 5 C -0.8363 -0.4371 -0.4310 C.3 1 UNL11111111 -0.4442 6 H -0.9706 -0.9624 -1.3789 H 1 UNL11111111 0.1700 7 C -1.3874 -1.0646 0.8267 C.3 1 UNL11111111 -0.3206 8 C -2.0553 0.1593 0.2480 C.3 1 UNL11111111 -0.0790 9 H -1.9331 1.1132 0.7896 H 1 UNL11111111 0.1779 10 C -3.3994 0.0392 -0.4174 C.3 1 UNL11111111 -0.4416 11 H 3.4921 0.4076 0.5990 H 1 UNL11111111 0.1607 12 H 3.9557 -1.2566 0.2508 H 1 UNL11111111 0.1436 13 H 3.5758 -0.1607 -1.0779 H 1 UNL11111111 0.1432 14 H 1.6373 -1.7488 -0.6359 H 1 UNL11111111 0.1532 15 H 1.5966 -1.2299 1.0523 H 1 UNL11111111 0.1645 16 H -1.8782 -2.0324 0.7686 H 1 UNL11111111 0.1562 17 H -0.8469 -0.9806 1.7685 H 1 UNL11111111 0.1665 18 H -4.2088 0.0960 0.3236 H 1 UNL11111111 0.1541 19 H -3.5569 0.8519 -1.1391 H 1 UNL11111111 0.1516 20 H -3.5215 -0.9065 -0.9581 H 1 UNL11111111 0.1449 @BOND 1 1 2 1 2 2 3 1 3 3 4 2 4 3 5 1 5 5 6 1 6 5 7 1 7 7 8 1 8 8 9 1 9 5 8 1 10 8 10 1 11 1 11 1 12 1 12 1 13 1 13 1 14 2 14 1 15 2 15 1 16 7 16 1 17 7 17 1 18 10 18 1 19 10 19 1 20 10 20 1