@MOLECULE dimetotiazine 51 53 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.4416 -0.5677 -0.9167 S.O2 1 UNL1111111111 2.3349 2 S 2.2548 -2.2430 1.2023 S.3 1 UNL1111111111 0.1050 3 O -3.2853 0.6981 -1.5985 O.2 1 UNL1111111111 -0.9001 4 O -4.1476 -1.6827 -1.4976 O.2 1 UNL1111111111 -0.8857 5 N 1.5924 0.3375 -0.2489 N.pl3 1 UNL1111111111 -0.4397 6 N -0.1688 3.6116 0.5496 N.3 1 UNL1111111111 -0.4082 7 N -4.2408 -0.2106 0.5994 N.3 1 UNL1111111111 -0.6971 8 C 0.4665 2.3042 0.8077 C.3 1 UNL1111111111 0.0582 9 C 1.2985 1.7679 -0.4075 C.3 1 UNL1111111111 -0.1327 10 C 0.5266 -0.5682 -0.1448 C.ar 1 UNL1111111111 0.2117 11 C 2.9136 -0.1149 -0.4272 C.ar 1 UNL1111111111 0.2282 12 C 0.7038 -1.8182 0.4804 C.ar 1 UNL1111111111 -0.1587 13 C 1.3578 2.3799 2.0538 C.3 1 UNL1111111111 -0.4615 14 C -0.7512 -0.2315 -0.6294 C.ar 1 UNL1111111111 -0.1994 15 C 3.3508 -1.2992 0.1930 C.ar 1 UNL1111111111 -0.1994 16 C -1.8158 -1.1034 -0.4475 C.ar 1 UNL1111111111 -0.3293 17 C -0.3525 -2.7147 0.5801 C.ar 1 UNL1111111111 -0.1063 18 C 3.8188 0.6062 -1.2260 C.ar 1 UNL1111111111 -0.2518 19 C -1.6215 -2.3560 0.1235 C.ar 1 UNL1111111111 -0.1474 20 C -1.2305 3.5239 -0.4758 C.3 1 UNL1111111111 -0.2787 21 C 0.7870 4.6817 0.2046 C.3 1 UNL1111111111 -0.2770 22 C 4.6604 -1.7398 0.0386 C.ar 1 UNL1111111111 -0.0726 23 C 5.1314 0.1669 -1.3586 C.ar 1 UNL1111111111 -0.0749 24 C 5.5585 -0.9989 -0.7262 C.ar 1 UNL1111111111 -0.2053 25 C -4.6439 -1.3646 1.4105 C.3 1 UNL1111111111 -0.2494 26 C -3.6595 0.8751 1.3979 C.3 1 UNL1111111111 -0.2443 27 H -0.3705 1.5869 1.0285 H 1 UNL1111111111 0.1457 28 H 0.7591 1.9506 -1.3634 H 1 UNL1111111111 0.1482 29 H 2.2467 2.3475 -0.4585 H 1 UNL1111111111 0.1558 30 H 2.2759 2.9497 1.8844 H 1 UNL1111111111 0.1468 31 H 0.8198 2.8562 2.8839 H 1 UNL1111111111 0.1632 32 H 1.6532 1.3735 2.3762 H 1 UNL1111111111 0.1571 33 H -0.8978 0.7171 -1.1596 H 1 UNL1111111111 0.1920 34 H -0.2067 -3.7032 1.0221 H 1 UNL1111111111 0.1644 35 H 3.4994 1.4973 -1.7605 H 1 UNL1111111111 0.1646 36 H -2.4385 -3.0754 0.2072 H 1 UNL1111111111 0.1671 37 H -1.9177 2.6895 -0.2517 H 1 UNL1111111111 0.1585 38 H -0.8704 3.3985 -1.5076 H 1 UNL1111111111 0.1242 39 H -1.8311 4.4484 -0.4341 H 1 UNL1111111111 0.1464 40 H 0.2410 5.6403 0.1656 H 1 UNL1111111111 0.1460 41 H 1.3060 4.5432 -0.7547 H 1 UNL1111111111 0.1160 42 H 1.5403 4.7770 1.0034 H 1 UNL1111111111 0.1478 43 H 4.9985 -2.6643 0.5132 H 1 UNL1111111111 0.1639 44 H 5.8288 0.7376 -1.9726 H 1 UNL1111111111 0.1531 45 H 6.5866 -1.3350 -0.8359 H 1 UNL1111111111 0.1583 46 H -5.1450 -2.1224 0.7755 H 1 UNL1111111111 0.1664 47 H -5.3961 -1.0413 2.1537 H 1 UNL1111111111 0.1450 48 H -3.8154 -1.8456 1.9564 H 1 UNL1111111111 0.1190 49 H -3.5410 1.7813 0.7698 H 1 UNL1111111111 0.1644 50 H -2.6901 0.6299 1.8631 H 1 UNL1111111111 0.1214 51 H -4.3591 1.1543 2.2066 H 1 UNL1111111111 0.1464 @BOND 1 1 3 2 2 1 4 2 3 1 7 1 4 1 16 1 5 2 12 1 6 2 15 1 7 5 9 1 8 5 10 1 9 5 11 1 10 6 8 1 11 6 20 1 12 6 21 1 13 7 25 1 14 7 26 1 15 8 9 1 16 8 13 1 17 8 27 1 18 9 28 1 19 9 29 1 20 10 12 ar 21 10 14 ar 22 11 15 ar 23 11 18 ar 24 12 17 ar 25 13 30 1 26 13 31 1 27 13 32 1 28 14 16 ar 29 14 33 1 30 15 22 ar 31 16 19 ar 32 17 19 ar 33 17 34 1 34 18 23 ar 35 18 35 1 36 19 36 1 37 20 37 1 38 20 38 1 39 20 39 1 40 21 40 1 41 21 41 1 42 21 42 1 43 22 24 ar 44 22 43 1 45 23 24 ar 46 23 44 1 47 24 45 1 48 25 46 1 49 25 47 1 50 25 48 1 51 26 49 1 52 26 50 1 53 26 51 1