@MOLECULE n-{3-[3-(1-piperidinylmethyl)phenoxy]propyl}-1,2-benzothiazol-3-amine 1,1-dioxide 56 59 0 0 0 SMALL GASTEIGER @ATOM 1 S -2.9737 0.4741 -1.3846 S.O2 1 UNL1111111111 2.3077 2 O 2.9206 2.5961 -0.0648 O.3 1 UNL1111111111 -0.3709 3 O -4.3132 0.9029 -1.6836 O.2 1 UNL1111111111 -0.8614 4 O -2.2882 -0.4380 -2.2580 O.2 1 UNL1111111111 -0.8510 5 N 1.5767 -2.3384 -0.6078 N.3 1 UNL1111111111 -0.4133 6 N -1.0493 2.9246 0.9037 N.pl3 1 UNL1111111111 -0.4888 7 N -1.9694 1.8534 -0.9886 N.2 1 UNL1111111111 -0.7932 8 C 0.8558 -3.3252 -1.4495 C.3 1 UNL1111111111 -0.1061 9 C 1.4535 -2.6675 0.8331 C.3 1 UNL1111111111 -0.1131 10 C -0.6396 -3.3033 -1.0877 C.3 1 UNL1111111111 -0.2776 11 C -0.0300 -2.6330 1.2402 C.3 1 UNL1111111111 -0.2747 12 C -0.8361 -3.6273 0.3962 C.3 1 UNL1111111111 -0.2658 13 C 3.0072 -2.2605 -1.0032 C.3 1 UNL1111111111 -0.1448 14 C 3.6101 -0.9994 -0.4369 C.ar 1 UNL1111111111 0.0816 15 C 2.9150 0.2040 -0.5637 C.ar 1 UNL1111111111 -0.3015 16 C 4.8566 -1.0357 0.1873 C.ar 1 UNL1111111111 -0.2602 17 C 3.4828 1.3600 -0.0364 C.ar 1 UNL1111111111 0.2625 18 C 1.0626 3.9739 0.1161 C.3 1 UNL1111111111 -0.3387 19 C 5.4154 0.1394 0.6935 C.ar 1 UNL1111111111 -0.0723 20 C -0.4699 4.0110 0.0970 C.3 1 UNL1111111111 -0.0711 21 C -2.1641 0.7057 1.1007 C.ar 1 UNL1111111111 -0.0956 22 C -1.6753 1.8745 0.2891 C.2 1 UNL1111111111 0.4082 23 C -2.9218 -0.1611 0.2971 C.ar 1 UNL1111111111 -0.3556 24 C 1.5937 2.7182 -0.5818 C.3 1 UNL1111111111 -0.0257 25 C 4.7386 1.3470 0.5919 C.ar 1 UNL1111111111 -0.2673 26 C -1.9519 0.4292 2.4375 C.ar 1 UNL1111111111 -0.1242 27 C -3.4912 -1.2992 0.8191 C.ar 1 UNL1111111111 -0.0672 28 C -2.5250 -0.7335 2.9744 C.ar 1 UNL1111111111 -0.1252 29 C -3.2872 -1.5821 2.1805 C.ar 1 UNL1111111111 -0.1367 30 H 1.2605 -4.3532 -1.3481 H 1 UNL1111111111 0.1041 31 H 0.9763 -3.0185 -2.5128 H 1 UNL1111111111 0.1398 32 H 1.8948 -3.6543 1.0870 H 1 UNL1111111111 0.1110 33 H 2.0166 -1.8979 1.4072 H 1 UNL1111111111 0.1409 34 H -1.1927 -4.0136 -1.7244 H 1 UNL1111111111 0.1297 35 H -1.0520 -2.2961 -1.3211 H 1 UNL1111111111 0.1825 36 H -0.4274 -1.6094 1.0896 H 1 UNL1111111111 0.1507 37 H -0.1293 -2.8573 2.3149 H 1 UNL1111111111 0.1227 38 H -1.9069 -3.5753 0.6614 H 1 UNL1111111111 0.1255 39 H -0.5148 -4.6619 0.6108 H 1 UNL1111111111 0.1272 40 H 3.5884 -3.1586 -0.7010 H 1 UNL1111111111 0.1245 41 H 3.0648 -2.2067 -2.1177 H 1 UNL1111111111 0.1571 42 H 1.9425 0.2012 -1.0563 H 1 UNL1111111111 0.1905 43 H 5.3961 -1.9728 0.2826 H 1 UNL1111111111 0.1538 44 H 1.4516 4.0115 1.1542 H 1 UNL1111111111 0.1604 45 H 1.4687 4.8821 -0.3700 H 1 UNL1111111111 0.1589 46 H -0.8532 3.9572 -0.9546 H 1 UNL1111111111 0.1930 47 H -0.8409 4.9748 0.5158 H 1 UNL1111111111 0.1414 48 H 6.3918 0.1076 1.1759 H 1 UNL1111111111 0.1460 49 H 1.6713 2.8315 -1.6767 H 1 UNL1111111111 0.1397 50 H 0.9854 1.8253 -0.3494 H 1 UNL1111111111 0.1450 51 H 5.1565 2.2687 0.9823 H 1 UNL1111111111 0.1662 52 H -0.6523 2.7941 1.8216 H 1 UNL1111111111 0.3058 53 H -1.3603 1.0828 3.0728 H 1 UNL1111111111 0.1511 54 H -4.0881 -1.9789 0.2079 H 1 UNL1111111111 0.1661 55 H -2.3675 -0.9683 4.0268 H 1 UNL1111111111 0.1537 56 H -3.7304 -2.4789 2.6121 H 1 UNL1111111111 0.1546 @BOND 1 1 3 2 2 1 4 2 3 1 7 1 4 1 23 1 5 2 17 1 6 2 24 1 7 5 8 1 8 5 9 1 9 5 13 1 10 6 20 1 11 6 22 1 12 6 52 1 13 7 22 2 14 8 10 1 15 8 30 1 16 8 31 1 17 9 11 1 18 9 32 1 19 9 33 1 20 10 12 1 21 10 34 1 22 10 35 1 23 11 12 1 24 11 36 1 25 11 37 1 26 12 38 1 27 12 39 1 28 13 14 1 29 13 40 1 30 13 41 1 31 14 15 ar 32 14 16 ar 33 15 17 ar 34 15 42 1 35 16 19 ar 36 16 43 1 37 17 25 ar 38 18 20 1 39 18 24 1 40 18 44 1 41 18 45 1 42 19 25 ar 43 19 48 1 44 20 46 1 45 20 47 1 46 21 22 1 47 21 23 ar 48 21 26 ar 49 23 27 ar 50 24 49 1 51 24 50 1 52 25 51 1 53 26 28 ar 54 26 53 1 55 27 29 ar 56 27 54 1 57 28 29 ar 58 28 55 1 59 29 56 1