@MOLECULE metiazic acid 32 34 0 0 0 SMALL GASTEIGER @ATOM 1 S -1.8202 1.9820 -0.1998 S.3 1 UNL1111 0.1134 2 O 5.6286 -1.0258 0.5228 O.3 1 UNL1111 -0.5825 3 O 3.8224 -0.6175 1.7604 O.2 1 UNL1111 -0.4729 4 N -1.0552 -0.8244 -0.9869 N.pl3 1 UNL1111 -0.4032 5 C 0.0428 0.0010 -0.6666 C.ar 1 UNL1111 0.2294 6 C -2.2344 -0.7447 -0.2129 C.ar 1 UNL1111 0.2154 7 C -0.1808 1.3408 -0.2952 C.ar 1 UNL1111 -0.1922 8 C -2.7137 0.5139 0.1954 C.ar 1 UNL1111 -0.1851 9 C 1.3636 -0.4647 -0.7641 C.ar 1 UNL1111 -0.2695 10 C 2.4268 0.4015 -0.5145 C.ar 1 UNL1111 0.0759 11 C 0.8859 2.1886 -0.0260 C.ar 1 UNL1111 -0.0697 12 C -0.7764 -2.0973 -1.6640 C.3 1 UNL1111 -0.2391 13 C 2.1948 1.7263 -0.1478 C.ar 1 UNL1111 -0.2139 14 C -2.9753 -1.8922 0.1139 C.ar 1 UNL1111 -0.2526 15 C 3.8323 -0.1022 -0.6385 C.3 1 UNL1111 -0.3610 16 C -3.9103 0.6242 0.8928 C.ar 1 UNL1111 -0.0838 17 C -4.1810 -1.7691 0.7980 C.ar 1 UNL1111 -0.0879 18 C -4.6547 -0.5181 1.1842 C.ar 1 UNL1111 -0.2006 19 C 4.3479 -0.5815 0.6837 C.2 1 UNL1111 0.6486 20 H 1.5691 -1.5027 -1.0087 H 1 UNL1111 0.1666 21 H 0.7139 3.2231 0.2826 H 1 UNL1111 0.1654 22 H -0.3837 -2.8738 -0.9851 H 1 UNL1111 0.1427 23 H -0.0505 -1.9303 -2.4817 H 1 UNL1111 0.1589 24 H -1.7013 -2.4713 -2.1428 H 1 UNL1111 0.1601 25 H 3.0262 2.3949 0.0601 H 1 UNL1111 0.1608 26 H -2.6157 -2.8828 -0.1490 H 1 UNL1111 0.1629 27 H 4.5101 0.6895 -1.0381 H 1 UNL1111 0.1938 28 H 3.9086 -0.9242 -1.3888 H 1 UNL1111 0.1913 29 H -4.2810 1.5995 1.2173 H 1 UNL1111 0.1639 30 H -4.7540 -2.6646 1.0390 H 1 UNL1111 0.1515 31 H -5.5975 -0.4308 1.7183 H 1 UNL1111 0.1567 32 H 6.0401 -1.3594 1.3553 H 1 UNL1111 0.3565 @BOND 1 1 7 1 2 1 8 1 3 2 19 1 4 2 32 1 5 3 19 2 6 4 5 1 7 4 6 1 8 4 12 1 9 5 7 ar 10 5 9 ar 11 6 8 ar 12 6 14 ar 13 7 11 ar 14 8 16 ar 15 9 10 ar 16 9 20 1 17 10 13 ar 18 10 15 1 19 11 13 ar 20 11 21 1 21 12 22 1 22 12 23 1 23 12 24 1 24 13 25 1 25 14 17 ar 26 14 26 1 27 15 19 1 28 15 27 1 29 15 28 1 30 16 18 ar 31 16 29 1 32 17 18 ar 33 17 30 1 34 18 31 1