@MOLECULE 1-methyl-1-pentylsulfanyl-cyclopropane 28 28 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.2594 0.5991 0.1946 C.3 1 UNL11111111 -0.4395 2 C 4.0632 -0.3522 0.2280 C.3 1 UNL11111111 -0.2502 3 C 2.7609 0.3980 -0.0807 C.3 1 UNL11111111 -0.2696 4 C 1.5608 -0.5619 -0.0478 C.3 1 UNL11111111 -0.2656 5 C 0.2754 0.2129 -0.3189 C.3 1 UNL11111111 -0.3110 6 S -1.1530 -0.9511 -0.3070 S.3 1 UNL11111111 -0.0455 7 C -2.5434 0.1866 -0.0674 C.3 1 UNL11111111 -0.0342 8 C -2.9038 0.9672 -1.2973 C.3 1 UNL11111111 -0.4394 9 C -3.6423 -0.2917 0.8599 C.3 1 UNL11111111 -0.3095 10 C -2.7296 0.8260 1.2955 C.3 1 UNL11111111 -0.3304 11 H 5.1548 1.4004 0.9345 H 1 UNL11111111 0.1424 12 H 6.1938 0.0701 0.4125 H 1 UNL11111111 0.1406 13 H 5.3699 1.0708 -0.7882 H 1 UNL11111111 0.1425 14 H 4.2111 -1.1709 -0.5015 H 1 UNL11111111 0.1351 15 H 3.9949 -0.8384 1.2197 H 1 UNL11111111 0.1351 16 H 2.6152 1.2151 0.6500 H 1 UNL11111111 0.1374 17 H 2.8317 0.8844 -1.0714 H 1 UNL11111111 0.1374 18 H 1.7087 -1.3652 -0.7974 H 1 UNL11111111 0.1485 19 H 1.5177 -1.0703 0.9365 H 1 UNL11111111 0.1493 20 H 0.1203 0.9967 0.4438 H 1 UNL11111111 0.1537 21 H 0.3198 0.7215 -1.2981 H 1 UNL11111111 0.1530 22 H -3.1526 0.3075 -2.1430 H 1 UNL11111111 0.1635 23 H -3.7804 1.6101 -1.1335 H 1 UNL11111111 0.1522 24 H -2.0873 1.6254 -1.6253 H 1 UNL11111111 0.1529 25 H -4.6784 -0.0814 0.6055 H 1 UNL11111111 0.1594 26 H -3.5784 -1.2638 1.3455 H 1 UNL11111111 0.1677 27 H -2.0100 0.6552 2.0929 H 1 UNL11111111 0.1650 28 H -3.1079 1.8431 1.3578 H 1 UNL11111111 0.1589 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 4 5 1 5 5 6 1 6 6 7 1 7 7 8 1 8 7 9 1 9 9 10 1 10 7 10 1 11 1 11 1 12 1 12 1 13 1 13 1 14 2 14 1 15 2 15 1 16 3 16 1 17 3 17 1 18 4 18 1 19 4 19 1 20 5 20 1 21 5 21 1 22 8 22 1 23 8 23 1 24 8 24 1 25 9 25 1 26 9 26 1 27 10 27 1 28 10 28 1