@MOLECULE 2,3-dimethoxy-12-[2-(methylamino)ethyl]benzo[c][1,3]benzodioxolo[5,6-h][1,6]naphthyridin-13(12h)-one 51 55 0 0 0 SMALL GASTEIGER @ATOM 1 O -5.4464 -0.4932 -1.5180 O.3 1 UNL11111 -0.3328 2 O -6.0763 1.4286 -0.3051 O.3 1 UNL11111 -0.3309 3 O 1.3385 -2.8021 -0.9878 O.2 1 UNL11111 -0.5118 4 O 4.7658 2.3604 0.4129 O.3 1 UNL11111 -0.2993 5 O 5.6583 -0.0386 -0.7914 O.3 1 UNL11111 -0.3241 6 N -0.3112 -1.3910 -0.3664 N.ar 1 UNL11111 -0.4401 7 N -1.5367 2.3779 1.0135 N.ar 1 UNL11111 -0.4096 8 N -1.0796 -2.4233 2.4647 N.3 1 UNL11111 -0.5313 9 C -0.7266 -0.0995 -0.0595 C.ar 1 UNL11111 0.3141 10 C 0.2224 0.8708 0.3083 C.ar 1 UNL11111 -0.2632 11 C -2.1056 0.3021 -0.1548 C.ar 1 UNL11111 -0.1554 12 C 1.6306 0.6309 0.0984 C.ar 1 UNL11111 0.1166 13 C 2.0222 -0.5976 -0.4483 C.ar 1 UNL11111 -0.2106 14 C -1.1255 -2.5649 0.0120 C.3 1 UNL11111 -0.0666 15 C 1.0528 -1.6746 -0.6397 C.ar 1 UNL11111 0.5931 16 C -2.4704 1.5272 0.4662 C.ar 1 UNL11111 0.2122 17 C -0.2589 2.0847 0.8796 C.ar 1 UNL11111 0.1327 18 C -3.0751 -0.4273 -0.9090 C.ar 1 UNL11111 -0.1694 19 C -0.5997 -3.2236 1.3199 C.3 1 UNL11111 -0.1371 20 C 2.6169 1.5906 0.3708 C.ar 1 UNL11111 -0.2779 21 C 3.3641 -0.8592 -0.7652 C.ar 1 UNL11111 -0.1431 22 C -4.3515 0.0347 -0.8809 C.ar 1 UNL11111 0.1154 23 C -3.8327 1.9762 0.5092 C.ar 1 UNL11111 -0.2237 24 C -4.7335 1.2116 -0.1583 C.ar 1 UNL11111 0.1708 25 C 3.9533 1.3351 0.0712 C.ar 1 UNL11111 0.2389 26 C 4.3274 0.0993 -0.5207 C.ar 1 UNL11111 0.0788 27 C -6.5502 0.3682 -1.1665 C.3 1 UNL11111 0.1567 28 C -0.0280 -1.5740 3.0552 C.3 1 UNL11111 -0.2774 29 C 6.1492 2.2693 0.0960 C.3 1 UNL11111 -0.1950 30 C 6.0404 -1.2084 -1.5041 C.3 1 UNL11111 -0.2003 31 H -2.1867 -2.2787 0.1830 H 1 UNL11111 0.1708 32 H -1.0840 -3.3006 -0.8243 H 1 UNL11111 0.1605 33 H 0.4497 2.8332 1.2643 H 1 UNL11111 0.1756 34 H -2.7871 -1.2881 -1.5094 H 1 UNL11111 0.1870 35 H -1.0048 -4.2566 1.3720 H 1 UNL11111 0.1347 36 H 0.5052 -3.3285 1.2862 H 1 UNL11111 0.1481 37 H 2.3580 2.5534 0.8096 H 1 UNL11111 0.1831 38 H 3.6144 -1.8304 -1.1998 H 1 UNL11111 0.1861 39 H -4.0804 2.8930 1.0391 H 1 UNL11111 0.1998 40 H -1.5007 -3.0151 3.1769 H 1 UNL11111 0.2549 41 H -6.9239 0.8301 -2.0908 H 1 UNL11111 0.1419 42 H -7.2742 -0.2282 -0.5942 H 1 UNL11111 0.1418 43 H -0.4825 -0.9512 3.8448 H 1 UNL11111 0.1484 44 H 0.3671 -0.8824 2.2905 H 1 UNL11111 0.1554 45 H 0.8178 -2.1292 3.4865 H 1 UNL11111 0.1181 46 H 6.2980 2.1782 -0.9852 H 1 UNL11111 0.1445 47 H 6.6191 1.4395 0.6352 H 1 UNL11111 0.1452 48 H 6.5298 3.2328 0.4607 H 1 UNL11111 0.1486 49 H 7.1181 -1.0525 -1.6428 H 1 UNL11111 0.1479 50 H 5.5332 -1.2627 -2.4731 H 1 UNL11111 0.1396 51 H 5.8584 -2.1065 -0.9046 H 1 UNL11111 0.1386 @BOND 1 1 22 1 2 1 27 1 3 2 24 1 4 2 27 1 5 3 15 2 6 4 25 1 7 4 29 1 8 5 26 1 9 5 30 1 10 6 9 ar 11 6 14 1 12 6 15 ar 13 7 16 ar 14 7 17 ar 15 8 19 1 16 8 28 1 17 8 40 1 18 9 10 ar 19 9 11 ar 20 10 12 ar 21 10 17 ar 22 11 16 ar 23 11 18 ar 24 12 13 ar 25 12 20 ar 26 13 15 ar 27 13 21 ar 28 14 19 1 29 14 31 1 30 14 32 1 31 16 23 ar 32 17 33 1 33 18 22 ar 34 18 34 1 35 19 35 1 36 19 36 1 37 20 25 ar 38 20 37 1 39 21 26 ar 40 21 38 1 41 22 24 ar 42 23 24 ar 43 23 39 1 44 25 26 ar 45 27 41 1 46 27 42 1 47 28 43 1 48 28 44 1 49 28 45 1 50 29 46 1 51 29 47 1 52 29 48 1 53 30 49 1 54 30 50 1 55 30 51 1