@MOLECULE [(1S)-1-methylbutyl]sulfanylcyclobutane 28 28 0 0 0 SMALL USER_CHARGES @ATOM 1 C -2.0538 -0.7406 -1.1376 C.3 1 UNL111 -0.2854 2 C -3.2750 -1.2747 -0.3425 C.3 1 UNL111 -0.2679 3 C -3.0693 -0.1638 0.7215 C.3 1 UNL111 -0.2701 4 C -1.8656 0.3860 -0.0877 C.3 1 UNL111 -0.1531 5 S -0.3088 0.3460 0.8634 S.3 1 UNL111 -0.1075 6 C 0.9290 0.8830 -0.4150 C.3 1 UNL111 -0.1098 7 H 0.6421 0.4109 -1.3826 H 1 UNL111 0.1454 8 C 0.9138 2.3994 -0.5593 C.3 1 UNL111 -0.4547 9 C 2.3126 0.3885 0.0138 C.3 1 UNL111 -0.2803 10 C 2.4952 -1.1172 -0.2231 C.3 1 UNL111 -0.2500 11 C 3.9150 -1.5496 0.1456 C.3 1 UNL111 -0.4384 12 H -1.2304 -1.4552 -1.2230 H 1 UNL111 0.1508 13 H -2.2884 -0.3806 -2.1426 H 1 UNL111 0.1393 14 H -4.2249 -1.2216 -0.8778 H 1 UNL111 0.1375 15 H -3.1542 -2.2916 0.0390 H 1 UNL111 0.1430 16 H -3.9009 0.5404 0.8141 H 1 UNL111 0.1420 17 H -2.8444 -0.5398 1.7247 H 1 UNL111 0.1542 18 H -2.0300 1.3962 -0.4926 H 1 UNL111 0.1469 19 H 1.6194 2.7277 -1.3344 H 1 UNL111 0.1486 20 H -0.0725 2.7837 -0.8467 H 1 UNL111 0.1483 21 H 1.2002 2.9079 0.3714 H 1 UNL111 0.1592 22 H 3.0871 0.9414 -0.5579 H 1 UNL111 0.1446 23 H 2.5172 0.6335 1.0749 H 1 UNL111 0.1519 24 H 1.7632 -1.6962 0.3731 H 1 UNL111 0.1494 25 H 2.2867 -1.3652 -1.2805 H 1 UNL111 0.1315 26 H 4.6651 -1.0232 -0.4541 H 1 UNL111 0.1397 27 H 4.1327 -1.3474 1.2007 H 1 UNL111 0.1441 28 H 4.0560 -2.6237 -0.0181 H 1 UNL111 0.1409 @BOND 1 1 2 1 2 2 3 1 3 3 4 1 4 1 4 1 5 4 5 1 6 5 6 1 7 6 7 1 8 6 8 1 9 6 9 1 10 9 10 1 11 10 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 8 19 1 20 8 20 1 21 8 21 1 22 9 22 1 23 9 23 1 24 10 24 1 25 10 25 1 26 11 26 1 27 11 27 1 28 11 28 1