@MOLECULE pentylsulfanylcyclobutane 28 28 0 0 0 SMALL USER_CHARGES @ATOM 1 C 5.4833 -0.5337 0.1394 C.3 1 UNL11111111 -0.4393 2 C 4.2636 0.2866 -0.2803 C.3 1 UNL11111111 -0.2500 3 C 2.9688 -0.3711 0.2145 C.3 1 UNL11111111 -0.2709 4 C 1.7438 0.4374 -0.2407 C.3 1 UNL11111111 -0.2639 5 C 0.4691 -0.2188 0.2803 C.3 1 UNL11111111 -0.3108 6 S -0.9770 0.8171 -0.1975 S.3 1 UNL11111111 -0.0694 7 C -2.3475 -0.1270 0.5474 C.3 1 UNL11111111 -0.1601 8 C -3.7053 0.6170 0.4529 C.3 1 UNL11111111 -0.2705 9 C -4.2894 -0.5577 -0.3764 C.3 1 UNL11111111 -0.2700 10 C -2.9204 -1.2856 -0.3111 C.3 1 UNL11111111 -0.2837 11 H 6.4132 -0.0633 -0.1986 H 1 UNL11111111 0.1406 12 H 5.5434 -0.6360 1.2286 H 1 UNL11111111 0.1424 13 H 5.4523 -1.5433 -0.2851 H 1 UNL11111111 0.1423 14 H 4.3432 1.3152 0.1198 H 1 UNL11111111 0.1353 15 H 4.2398 0.3912 -1.3816 H 1 UNL11111111 0.1353 16 H 2.9029 -1.4080 -0.1643 H 1 UNL11111111 0.1375 17 H 2.9855 -0.4500 1.3176 H 1 UNL11111111 0.1374 18 H 1.8332 1.4809 0.1240 H 1 UNL11111111 0.1498 19 H 1.7321 0.5038 -1.3473 H 1 UNL11111111 0.1485 20 H 0.3499 -1.2342 -0.1371 H 1 UNL11111111 0.1518 21 H 0.5022 -0.3219 1.3790 H 1 UNL11111111 0.1508 22 H -2.0847 -0.4303 1.5724 H 1 UNL11111111 0.1470 23 H -4.1900 0.7806 1.4196 H 1 UNL11111111 0.1427 24 H -3.6940 1.5763 -0.0743 H 1 UNL11111111 0.1533 25 H -5.1104 -1.0909 0.1074 H 1 UNL11111111 0.1385 26 H -4.6074 -0.2834 -1.3853 H 1 UNL11111111 0.1429 27 H -2.4466 -1.4344 -1.2861 H 1 UNL11111111 0.1531 28 H -2.9430 -2.2520 0.1991 H 1 UNL11111111 0.1393 @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 8 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 7 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