@MOLECULE (2R)-2-tert-butylsulfanyl-1,1-dimethyl-cyclopropane 28 28 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.9535 1.0567 -1.1710 C.3 1 UNL11111111 -0.4711 2 C -2.0378 0.1152 0.0262 C.3 1 UNL11111111 0.1157 3 C -2.3237 0.8978 1.3048 C.3 1 UNL11111111 -0.4683 4 C -3.1116 -0.9471 -0.2030 C.3 1 UNL11111111 -0.4621 5 S -0.4371 -0.8429 0.2228 S.3 1 UNL11111111 -0.0972 6 C 0.8227 0.4378 0.1613 C.3 1 UNL11111111 -0.2559 7 H 0.6016 1.2553 0.8553 H 1 UNL11111111 0.1666 8 C 1.5250 0.7674 -1.1367 C.3 1 UNL11111111 -0.3544 9 C 2.2863 0.0561 -0.0354 C.3 1 UNL11111111 0.0841 10 C 3.3002 0.8471 0.7585 C.3 1 UNL11111111 -0.4483 11 C 2.6987 -1.3794 -0.2295 C.3 1 UNL11111111 -0.4448 12 H -1.1718 1.8174 -1.0517 H 1 UNL11111111 0.1533 13 H -1.7444 0.5213 -2.1062 H 1 UNL11111111 0.1575 14 H -2.9000 1.5938 -1.3147 H 1 UNL11111111 0.1513 15 H -3.2895 1.4157 1.2379 H 1 UNL11111111 0.1508 16 H -2.3720 0.2468 2.1879 H 1 UNL11111111 0.1596 17 H -1.5665 1.6645 1.5063 H 1 UNL11111111 0.1479 18 H -2.9276 -1.5394 -1.1092 H 1 UNL11111111 0.1576 19 H -3.1962 -1.6485 0.6375 H 1 UNL11111111 0.1571 20 H -4.0974 -0.4792 -0.3254 H 1 UNL11111111 0.1507 21 H 1.2731 0.2312 -2.0484 H 1 UNL11111111 0.1679 22 H 1.7501 1.8027 -1.3741 H 1 UNL11111111 0.1572 23 H 3.0139 1.8983 0.8795 H 1 UNL11111111 0.1474 24 H 3.4259 0.4254 1.7646 H 1 UNL11111111 0.1551 25 H 4.2822 0.8340 0.2677 H 1 UNL11111111 0.1536 26 H 3.7136 -1.4459 -0.6426 H 1 UNL11111111 0.1503 27 H 2.6915 -1.9270 0.7231 H 1 UNL11111111 0.1575 28 H 2.0408 -1.9241 -0.9198 H 1 UNL11111111 0.1609 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 6 1 6 6 7 1 7 6 8 1 8 8 9 1 9 6 9 1 10 9 10 1 11 9 11 1 12 1 12 1 13 1 13 1 14 1 14 1 15 3 15 1 16 3 16 1 17 3 17 1 18 4 18 1 19 4 19 1 20 4 20 1 21 8 21 1 22 8 22 1 23 10 23 1 24 10 24 1 25 10 25 1 26 11 26 1 27 11 27 1 28 11 28 1