@MOLECULE n,n-dimethyl-n'-(1,3,7-trimethyl-1h-pyrazolo[3,4-b]quinolin-4-yl)-1,3-propanediamine 48 50 0 0 0 SMALL GASTEIGER @ATOM 1 N 0.3457 1.3877 -1.8646 N.pl3 1 UNL1111111111 -0.5070 2 N 3.0222 -1.2747 0.9230 N.ar 1 UNL1111111111 -0.1757 3 N 0.7194 -2.0528 0.6713 N.ar 1 UNL1111111111 -0.4924 4 N -1.8587 2.3229 1.2196 N.3 1 UNL1111111111 -0.3937 5 N 3.8047 -0.2996 0.3516 N.ar 1 UNL1111111111 -0.2383 6 C 0.4639 0.2432 -1.0755 C.ar 1 UNL1111111111 0.3476 7 C 1.6899 -0.0854 -0.4959 C.ar 1 UNL1111111111 -0.3734 8 C -0.6178 -0.6703 -0.8732 C.ar 1 UNL1111111111 -0.2434 9 C -0.7183 2.3586 -1.5366 C.3 1 UNL1111111111 -0.0788 10 C 1.7414 -1.2473 0.3682 C.ar 1 UNL1111111111 0.3205 11 C -0.3090 3.3213 -0.4054 C.3 1 UNL1111111111 -0.3105 12 C -0.4552 -1.7626 0.0382 C.ar 1 UNL1111111111 0.2698 13 C 3.0346 0.4531 -0.4451 C.ar 1 UNL1111111111 0.1339 14 C -0.4311 2.6477 0.9778 C.3 1 UNL1111111111 -0.1204 15 C -1.8525 -0.5737 -1.5745 C.ar 1 UNL1111111111 -0.0382 16 C -1.5666 -2.6170 0.3234 C.ar 1 UNL1111111111 -0.2489 17 C -2.7589 -2.4392 -0.3232 C.ar 1 UNL1111111111 0.1163 18 C -2.8929 -1.4192 -1.3096 C.ar 1 UNL1111111111 -0.2495 19 C 3.5689 1.6404 -1.1410 C.3 1 UNL1111111111 -0.4344 20 C 3.6617 -2.4357 1.5231 C.3 1 UNL1111111111 -0.2098 21 C -2.5509 3.4336 1.9071 C.3 1 UNL1111111111 -0.2774 22 C -2.0004 1.0698 1.9895 C.3 1 UNL1111111111 -0.2841 23 C -3.9362 -3.3060 -0.0316 C.3 1 UNL1111111111 -0.4632 24 H -0.9428 2.9219 -2.4692 H 1 UNL1111111111 0.1409 25 H -1.6593 1.8369 -1.2365 H 1 UNL1111111111 0.1846 26 H -0.9652 4.2120 -0.4416 H 1 UNL1111111111 0.1504 27 H 0.7201 3.6915 -0.5495 H 1 UNL1111111111 0.1338 28 H 1.2356 1.8486 -2.0605 H 1 UNL1111111111 0.2877 29 H 0.0021 3.3061 1.7587 H 1 UNL1111111111 0.1208 30 H 0.1801 1.7179 0.9911 H 1 UNL1111111111 0.1457 31 H -1.9461 0.1822 -2.3581 H 1 UNL1111111111 0.1588 32 H -1.4162 -3.4063 1.0589 H 1 UNL1111111111 0.1796 33 H -3.8317 -1.3334 -1.8486 H 1 UNL1111111111 0.1547 34 H 3.4886 1.5375 -2.2345 H 1 UNL1111111111 0.1647 35 H 3.0504 2.5602 -0.8314 H 1 UNL1111111111 0.1597 36 H 4.6409 1.7923 -0.9170 H 1 UNL1111111111 0.1807 37 H 4.1254 -3.0914 0.7641 H 1 UNL1111111111 0.1485 38 H 4.4477 -2.1067 2.2285 H 1 UNL1111111111 0.1628 39 H 2.8961 -3.0166 2.0771 H 1 UNL1111111111 0.1758 40 H -2.4403 4.3555 1.3151 H 1 UNL1111111111 0.1372 41 H -2.1937 3.6300 2.9288 H 1 UNL1111111111 0.1189 42 H -3.6283 3.2034 1.9533 H 1 UNL1111111111 0.1434 43 H -3.0703 0.8538 2.1389 H 1 UNL1111111111 0.1437 44 H -1.5027 1.0737 2.9696 H 1 UNL1111111111 0.1233 45 H -1.5902 0.2347 1.3917 H 1 UNL1111111111 0.1588 46 H -4.2651 -3.8480 -0.9304 H 1 UNL1111111111 0.1594 47 H -3.7293 -4.0597 0.7400 H 1 UNL1111111111 0.1566 48 H -4.7910 -2.7093 0.3199 H 1 UNL1111111111 0.1606 @BOND 1 1 6 1 2 1 9 1 3 1 28 1 4 2 5 ar 5 2 10 ar 6 2 20 1 7 3 10 ar 8 3 12 ar 9 4 14 1 10 4 21 1 11 4 22 1 12 5 13 ar 13 6 7 ar 14 6 8 ar 15 7 10 ar 16 7 13 ar 17 8 12 ar 18 8 15 ar 19 9 11 1 20 9 24 1 21 9 25 1 22 11 14 1 23 11 26 1 24 11 27 1 25 12 16 ar 26 13 19 1 27 14 29 1 28 14 30 1 29 15 18 ar 30 15 31 1 31 16 17 ar 32 16 32 1 33 17 18 ar 34 17 23 1 35 18 33 1 36 19 34 1 37 19 35 1 38 19 36 1 39 20 37 1 40 20 38 1 41 20 39 1 42 21 40 1 43 21 41 1 44 21 42 1 45 22 43 1 46 22 44 1 47 22 45 1 48 23 46 1 49 23 47 1 50 23 48 1