@MOLECULE S-ethyl 3,3-dimethylcyclobutanecarbothioate 27 27 0 0 0 SMALL USER_CHARGES @ATOM 1 C -1.9953 -1.0962 -0.2718 C.3 1 UNL11111111 -0.2924 2 C -2.5827 0.2592 0.2359 C.3 1 UNL11111111 0.1069 3 C -3.9357 0.6034 -0.3591 C.3 1 UNL11111111 -0.4657 4 C -2.5905 0.3877 1.7492 C.3 1 UNL11111111 -0.4653 5 C -1.3858 1.0079 -0.4366 C.3 1 UNL11111111 -0.2937 6 C -0.7905 -0.3468 -0.9092 C.3 1 UNL11111111 -0.2209 7 C 0.5200 -0.7104 -0.2970 C.2 1 UNL11111111 0.4297 8 O 0.7210 -1.6907 0.3621 O.2 1 UNL11111111 -0.4345 9 S 1.8708 0.4595 -0.6316 S.3 1 UNL11111111 -0.1353 10 C 3.2111 -0.2448 0.4194 C.3 1 UNL11111111 -0.2676 11 C 4.2739 0.8095 0.6595 C.3 1 UNL11111111 -0.4361 12 H -1.7249 -1.8026 0.5205 H 1 UNL11111111 0.1644 13 H -2.6242 -1.6272 -0.9886 H 1 UNL11111111 0.1455 14 H -4.7154 -0.0754 0.0069 H 1 UNL11111111 0.1496 15 H -4.2395 1.6236 -0.0956 H 1 UNL11111111 0.1483 16 H -3.9304 0.5357 -1.4531 H 1 UNL11111111 0.1473 17 H -1.6206 0.1166 2.1848 H 1 UNL11111111 0.1537 18 H -2.8143 1.4141 2.0616 H 1 UNL11111111 0.1481 19 H -3.3432 -0.2674 2.2034 H 1 UNL11111111 0.1500 20 H -1.6700 1.6769 -1.2526 H 1 UNL11111111 0.1491 21 H -0.7693 1.5817 0.2601 H 1 UNL11111111 0.1552 22 H -0.7487 -0.4488 -2.0109 H 1 UNL11111111 0.1724 23 H 2.7774 -0.6029 1.3738 H 1 UNL11111111 0.1681 24 H 3.6311 -1.1373 -0.0813 H 1 UNL11111111 0.1616 25 H 4.7531 1.1457 -0.2701 H 1 UNL11111111 0.1535 26 H 3.8797 1.7007 1.1670 H 1 UNL11111111 0.1558 27 H 5.0744 0.4107 1.3001 H 1 UNL11111111 0.1524 @BOND 1 1 2 1 2 2 3 1 3 2 4 1 4 2 5 1 5 5 6 1 6 1 6 1 7 6 7 1 8 7 8 2 9 7 9 1 10 9 10 1 11 10 11 1 12 1 12 1 13 1 13 1 14 3 14 1 15 3 15 1 16 3 16 1 17 4 17 1 18 4 18 1 19 4 19 1 20 5 20 1 21 5 21 1 22 6 22 1 23 10 23 1 24 10 24 1 25 11 25 1 26 11 26 1 27 11 27 1