@MOLECULE 1,3-dithiane 14 14 0 0 0 SMALL USER_CHARGES @ATOM 1 C 0.1039 1.6792 -0.4614 C.3 1 UNL11111111 -0.2655 2 C 1.4479 1.0734 -0.0683 C.3 1 UNL11111111 -0.3299 3 S 1.4264 -0.7363 0.2537 S.3 1 UNL11111111 0.0014 4 C -0.0992 -1.2921 -0.5626 C.3 1 UNL11111111 -0.3952 5 S -1.6148 -0.4823 0.0642 S.3 1 UNL11111111 -0.0110 6 C -1.0477 1.2278 0.4269 C.3 1 UNL11111111 -0.3210 7 H -1.9319 1.8788 0.2833 H 1 UNL11111111 0.1634 8 H 0.1886 2.7895 -0.4050 H 1 UNL11111111 0.1518 9 H 1.8287 1.5424 0.8594 H 1 UNL11111111 0.1645 10 H -0.0262 -1.1562 -1.6556 H 1 UNL11111111 0.1720 11 H -0.1988 -2.3798 -0.3756 H 1 UNL11111111 0.1881 12 H 2.2002 1.2731 -0.8553 H 1 UNL11111111 0.1601 13 H -0.1186 1.4808 -1.5312 H 1 UNL11111111 0.1540 14 H -0.7752 1.2979 1.4975 H 1 UNL11111111 0.1671 @BOND 1 8 1 1 2 12 2 1 3 9 2 1 4 1 2 1 5 1 13 1 6 1 6 1 7 2 3 1 8 7 6 1 9 14 6 1 10 6 5 1 11 3 4 1 12 10 4 1 13 5 4 1 14 4 11 1