@MOLECULE 5-[(2-aminoethyl)amino]-2-[2-(diethylamino)ethyl]-2h-thiochromeno[4,3,2-cd]indazol-9-ol 55 58 0 0 0 SMALL GASTEIGER @ATOM 1 S -3.1580 -0.2735 0.1083 S.2 1 UNL1111111111 0.1135 2 O -1.8911 -6.0285 0.1793 O.3 1 UNL1111111111 -0.4726 3 N 1.6096 -0.4704 -0.8730 N.ar 1 UNL1111111111 -0.1431 4 N 5.0210 0.4216 0.2744 N.3 1 UNL1111111111 -0.4429 5 N 1.0247 -1.6739 -0.6557 N.ar 1 UNL1111111111 -0.1802 6 N -2.7901 2.8468 -0.0886 N.pl3 1 UNL1111111111 -0.5179 7 N -3.8781 6.3204 0.7307 N.3 1 UNL1111111111 -0.6458 8 C -0.5453 -0.0409 -0.4005 C.ar 1 UNL1111111111 -0.0650 9 C 0.7015 0.5778 -0.6810 C.ar 1 UNL1111111111 0.0174 10 C 3.0610 -0.3631 -0.9172 C.3 1 UNL1111111111 -0.0653 11 C -0.2876 -1.4563 -0.4025 C.ar 1 UNL1111111111 -0.0134 12 C 3.6266 -0.0189 0.4892 C.3 1 UNL1111111111 -0.1429 13 C -1.7119 0.6800 -0.1805 C.ar 1 UNL1111111111 -0.2068 14 C -1.3292 -2.4236 -0.1501 C.ar 1 UNL1111111111 0.0906 15 C -1.6316 2.0755 -0.2273 C.ar 1 UNL1111111111 0.2116 16 C 0.7810 1.9764 -0.7550 C.ar 1 UNL1111111111 -0.1350 17 C -2.6356 -1.9748 0.1056 C.ar 1 UNL1111111111 -0.1521 18 C -0.3725 2.6938 -0.5228 C.ar 1 UNL1111111111 -0.2026 19 C 5.1058 1.8999 0.1586 C.3 1 UNL1111111111 -0.0876 20 C 5.9361 -0.1070 1.3148 C.3 1 UNL1111111111 -0.0861 21 C -1.0439 -3.7918 -0.1411 C.ar 1 UNL1111111111 -0.2904 22 C -3.6541 -2.8943 0.3714 C.ar 1 UNL1111111111 -0.0755 23 C -2.6542 4.2831 0.2097 C.3 1 UNL1111111111 -0.0892 24 C 6.3633 2.2768 -0.6355 C.3 1 UNL1111111111 -0.4474 25 C 6.2282 -1.5862 1.0307 C.3 1 UNL1111111111 -0.4461 26 C -2.0778 -4.6839 0.1359 C.ar 1 UNL1111111111 0.2924 27 C -3.3858 -4.2568 0.3930 C.ar 1 UNL1111111111 -0.2433 28 C -4.0598 4.8751 0.4836 C.3 1 UNL1111111111 -0.1239 29 H 3.5023 -1.3216 -1.2800 H 1 UNL1111111111 0.1779 30 H 3.3393 0.4211 -1.6585 H 1 UNL1111111111 0.1620 31 H 2.9925 0.7418 0.9907 H 1 UNL1111111111 0.1334 32 H 3.5801 -0.9245 1.1320 H 1 UNL1111111111 0.1547 33 H 1.7194 2.4703 -0.9900 H 1 UNL1111111111 0.1597 34 H -0.3286 3.7811 -0.5751 H 1 UNL1111111111 0.1644 35 H 5.1058 2.4065 1.1467 H 1 UNL1111111111 0.1127 36 H 4.2102 2.2685 -0.3895 H 1 UNL1111111111 0.1334 37 H 5.5344 0.0194 2.3424 H 1 UNL1111111111 0.1126 38 H 6.8895 0.4650 1.2745 H 1 UNL1111111111 0.1344 39 H -0.0320 -4.1351 -0.3462 H 1 UNL1111111111 0.1829 40 H -3.5651 2.4041 0.3954 H 1 UNL1111111111 0.2985 41 H -4.6762 -2.5593 0.5669 H 1 UNL1111111111 0.1629 42 H -2.1996 4.7911 -0.6707 H 1 UNL1111111111 0.1480 43 H -1.9910 4.4761 1.0830 H 1 UNL1111111111 0.1468 44 H 6.3409 3.3299 -0.9311 H 1 UNL1111111111 0.1402 45 H 6.4417 1.6679 -1.5468 H 1 UNL1111111111 0.1624 46 H 7.2790 2.1086 -0.0606 H 1 UNL1111111111 0.1413 47 H 7.0076 -1.9669 1.6971 H 1 UNL1111111111 0.1390 48 H 6.5699 -1.7198 -0.0043 H 1 UNL1111111111 0.1591 49 H 5.3384 -2.2127 1.1573 H 1 UNL1111111111 0.1499 50 H -4.1606 -4.9870 0.6050 H 1 UNL1111111111 0.1741 51 H -4.7395 4.6540 -0.3676 H 1 UNL1111111111 0.1273 52 H -4.5024 4.4067 1.3892 H 1 UNL1111111111 0.1407 53 H -0.9552 -6.2805 -0.0127 H 1 UNL1111111111 0.3293 54 H -3.7214 6.8329 -0.1210 H 1 UNL1111111111 0.2498 55 H -4.6611 6.7234 1.2162 H 1 UNL1111111111 0.2522 @BOND 1 1 13 ar 2 1 17 ar 3 2 26 1 4 2 53 1 5 3 5 ar 6 3 9 ar 7 3 10 1 8 4 12 1 9 4 19 1 10 4 20 1 11 5 11 ar 12 6 15 1 13 6 23 1 14 6 40 1 15 7 28 1 16 7 54 1 17 7 55 1 18 8 9 ar 19 8 11 ar 20 8 13 ar 21 9 16 ar 22 10 12 1 23 10 29 1 24 10 30 1 25 11 14 ar 26 12 31 1 27 12 32 1 28 13 15 ar 29 14 17 ar 30 14 21 ar 31 15 18 ar 32 16 18 ar 33 16 33 1 34 17 22 ar 35 18 34 1 36 19 24 1 37 19 35 1 38 19 36 1 39 20 25 1 40 20 37 1 41 20 38 1 42 21 26 ar 43 21 39 1 44 22 27 ar 45 22 41 1 46 23 28 1 47 23 42 1 48 23 43 1 49 24 44 1 50 24 45 1 51 24 46 1 52 25 47 1 53 25 48 1 54 25 49 1 55 26 27 ar 56 27 50 1 57 28 51 1 58 28 52 1