@MOLECULE 2-(octylsulfonyl)acetamide 36 35 0 0 0 SMALL GASTEIGER @ATOM 1 S 2.1857 -0.3942 0.0350 S.O2 1 UNL1111111111 2.2260 2 O 2.2839 -1.0706 1.3029 O.2 1 UNL1111111111 -0.8757 3 O 2.1847 -1.0821 -1.2305 O.2 1 UNL1111111111 -0.8745 4 O 5.2014 -0.7906 -0.0957 O.2 1 UNL1111111111 -0.4748 5 N 5.8640 1.3499 -0.0577 N.am 1 UNL1111111111 -0.7150 6 C -1.8262 0.6135 0.0663 C.3 1 UNL1111111111 -0.2743 7 C -0.5624 -0.2586 0.0331 C.3 1 UNL1111111111 -0.2440 8 C -3.0837 -0.2623 0.0013 C.3 1 UNL1111111111 -0.2770 9 C -4.3503 0.6017 0.0231 C.3 1 UNL1111111111 -0.2810 10 C 0.6917 0.6172 0.0919 C.3 1 UNL1111111111 -0.5924 11 C -5.6059 -0.2776 -0.0377 C.3 1 UNL1111111111 -0.2679 12 C -6.8754 0.5840 -0.0118 C.3 1 UNL1111111111 -0.2518 13 C 3.4670 0.9031 -0.0220 C.3 1 UNL1111111111 -0.7014 14 C -8.1278 -0.2901 -0.0764 C.3 1 UNL1111111111 -0.4389 15 C 4.8761 0.3721 -0.0602 C.2 1 UNL1111111111 0.6214 16 H -1.8208 1.3269 -0.7783 H 1 UNL1111111111 0.1333 17 H -1.8427 1.2282 0.9851 H 1 UNL1111111111 0.1337 18 H -0.5854 -0.9736 0.8828 H 1 UNL1111111111 0.1548 19 H -0.5670 -0.8808 -0.8878 H 1 UNL1111111111 0.1576 20 H -3.0668 -0.8848 -0.9136 H 1 UNL1111111111 0.1413 21 H -3.0965 -0.9725 0.8499 H 1 UNL1111111111 0.1412 22 H 0.6773 1.3341 -0.7484 H 1 UNL1111111111 0.1636 23 H 0.6750 1.2200 1.0183 H 1 UNL1111111111 0.1666 24 H -4.3693 1.2251 0.9363 H 1 UNL1111111111 0.1358 25 H -4.3426 1.3090 -0.8269 H 1 UNL1111111111 0.1356 26 H -5.6140 -0.9873 0.8106 H 1 UNL1111111111 0.1383 27 H -5.5903 -0.8991 -0.9524 H 1 UNL1111111111 0.1382 28 H -6.8938 1.2035 0.9046 H 1 UNL1111111111 0.1334 29 H -6.8672 1.2959 -0.8586 H 1 UNL1111111111 0.1333 30 H 3.2929 1.5315 -0.9177 H 1 UNL1111111111 0.1899 31 H 3.3450 1.5592 0.8616 H 1 UNL1111111111 0.1884 32 H -8.1771 -0.9828 0.7713 H 1 UNL1111111111 0.1432 33 H -9.0385 0.3187 -0.0575 H 1 UNL1111111111 0.1407 34 H -8.1515 -0.8892 -0.9936 H 1 UNL1111111111 0.1432 35 H 6.8262 1.0770 -0.0854 H 1 UNL1111111111 0.3126 36 H 5.6752 2.3227 -0.0317 H 1 UNL1111111111 0.2967 @BOND 1 1 2 2 2 1 3 2 3 1 10 1 4 1 13 1 5 4 15 2 6 5 15 am 7 5 35 1 8 5 36 1 9 6 7 1 10 6 8 1 11 6 16 1 12 6 17 1 13 7 10 1 14 7 18 1 15 7 19 1 16 8 9 1 17 8 20 1 18 8 21 1 19 9 11 1 20 9 24 1 21 9 25 1 22 10 22 1 23 10 23 1 24 11 12 1 25 11 26 1 26 11 27 1 27 12 14 1 28 12 28 1 29 12 29 1 30 13 15 1 31 13 30 1 32 13 31 1 33 14 32 1 34 14 33 1 35 14 34 1