@MOLECULE (4s)-4-(isobutylamino)-5,6-dihydro-4h-thieno[2,3-b]thiopyran-2-sulfonamide 7,7-dioxide 38 39 0 0 0 SMALL GASTEIGER @ATOM 1 S -0.6968 -2.6996 -0.2034 S.O2 1 UNL1111111 2.2359 2 S 1.9721 -1.1929 -0.3858 S.2 1 UNL1111111 0.6175 3 S 3.5261 1.4244 0.0682 S.O2 1 UNL1111111 2.3892 4 O -0.6143 -3.0531 -1.6047 O.2 1 UNL1111111 -0.9055 5 O -0.3567 -3.6851 0.8010 O.2 1 UNL1111111 -0.9054 6 O 3.3064 2.5816 0.9004 O.2 1 UNL1111111 -0.9162 7 O 4.7071 0.6046 0.1774 O.2 1 UNL1111111 -0.9085 8 N -2.1824 0.9635 0.1075 N.3 1 UNL1111111 -0.5670 9 N 3.5088 2.0027 -1.5706 N.3 1 UNL1111111 -0.9470 10 C -1.4905 0.1307 1.1286 C.3 1 UNL1111111 0.0316 11 C -2.2935 -1.1684 1.3798 C.3 1 UNL1111111 -0.2680 12 C -0.1005 -0.1354 0.6354 C.ar 1 UNL1111111 -0.0371 13 C -2.3275 -2.0715 0.1527 C.3 1 UNL1111111 -0.5760 14 C 0.3440 -1.3099 0.0534 C.ar 1 UNL1111111 -0.5703 15 C -3.3858 1.6457 0.6282 C.3 1 UNL1111111 -0.1281 16 C 0.9151 0.8553 0.6952 C.ar 1 UNL1111111 -0.1223 17 C -3.9958 2.5334 -0.4823 C.3 1 UNL1111111 -0.0717 18 C 2.1161 0.4204 0.1635 C.ar 1 UNL1111111 -0.5846 19 C -4.4788 1.6756 -1.6546 C.3 1 UNL1111111 -0.4479 20 C -5.1605 3.3356 0.1069 C.3 1 UNL1111111 -0.4573 21 H -1.4206 0.6752 2.1152 H 1 UNL1111111 0.1293 22 H -3.3310 -0.9052 1.6724 H 1 UNL1111111 0.1558 23 H -1.8735 -1.6985 2.2613 H 1 UNL1111111 0.1580 24 H -3.0395 -2.9062 0.2985 H 1 UNL1111111 0.1839 25 H -2.7212 -1.4998 -0.7197 H 1 UNL1111111 0.2051 26 H -1.5294 1.6311 -0.3036 H 1 UNL1111111 0.2636 27 H -3.1706 2.2637 1.5270 H 1 UNL1111111 0.1121 28 H -4.1237 0.8725 0.9360 H 1 UNL1111111 0.1453 29 H 0.7517 1.8370 1.1278 H 1 UNL1111111 0.1759 30 H -3.2163 3.2429 -0.8511 H 1 UNL1111111 0.1309 31 H -5.2614 0.9741 -1.3473 H 1 UNL1111111 0.1432 32 H -4.8796 2.2916 -2.4651 H 1 UNL1111111 0.1429 33 H -3.6548 1.0735 -2.0630 H 1 UNL1111111 0.1602 34 H -5.9546 2.6797 0.4801 H 1 UNL1111111 0.1466 35 H -5.6103 3.9879 -0.6516 H 1 UNL1111111 0.1515 36 H -4.8376 3.9745 0.9356 H 1 UNL1111111 0.1433 37 H 3.2590 2.9686 -1.7050 H 1 UNL1111111 0.2948 38 H 4.3021 1.7621 -2.1425 H 1 UNL1111111 0.2964 @BOND 1 1 4 2 2 1 5 2 3 1 13 1 4 1 14 1 5 2 14 ar 6 2 18 ar 7 3 6 2 8 3 7 2 9 3 9 1 10 3 18 1 11 8 10 1 12 8 15 1 13 8 26 1 14 9 37 1 15 9 38 1 16 10 11 1 17 10 12 1 18 10 21 1 19 11 13 1 20 11 22 1 21 11 23 1 22 12 14 ar 23 12 16 ar 24 13 24 1 25 13 25 1 26 15 17 1 27 15 27 1 28 15 28 1 29 16 18 ar 30 16 29 1 31 17 19 1 32 17 20 1 33 17 30 1 34 19 31 1 35 19 32 1 36 19 33 1 37 20 34 1 38 20 35 1 39 20 36 1