@MOLECULE 7-ethoxy-8-methoxy[1,3]benzodioxolo[6,5,4-cd]benzo[f]indol-5(6h)-one 40 44 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.0554 2.1580 0.1468 O.3 1 UNL1111111111 -0.3327 2 O 4.7495 0.5247 0.0905 O.3 1 UNL1111111111 -0.3324 3 O -2.7012 -1.1953 -0.1721 O.3 1 UNL1111111111 -0.3561 4 O -3.7169 1.2190 -0.0246 O.3 1 UNL1111111111 -0.3580 5 O 1.6399 -4.2232 -0.2540 O.2 1 UNL1111111111 -0.4622 6 N -0.1656 -2.7944 -0.2044 N.ar 1 UNL1111111111 -0.5468 7 C 0.9440 -0.7898 -0.0907 C.ar 1 UNL1111111111 -0.0257 8 C 1.1415 0.5888 0.0039 C.ar 1 UNL1111111111 -0.0540 9 C -0.3642 -1.4032 -0.1369 C.ar 1 UNL1111111111 0.0888 10 C -0.0341 1.4265 0.0340 C.ar 1 UNL1111111111 0.0353 11 C 1.9445 -1.7879 -0.1215 C.ar 1 UNL1111111111 -0.1566 12 C -1.3221 0.8291 -0.0278 C.ar 1 UNL1111111111 -0.1053 13 C -1.4724 -0.6094 -0.0831 C.ar 1 UNL1111111111 0.1512 14 C 2.5007 0.9126 0.0562 C.ar 1 UNL1111111111 0.1715 15 C 3.5102 -0.0708 0.0212 C.ar 1 UNL1111111111 0.0789 16 C 3.2826 -1.4432 -0.0662 C.ar 1 UNL1111111111 -0.0747 17 C 1.2273 -3.0967 -0.2029 C.ar 1 UNL1111111111 0.6040 18 C -2.4321 1.7037 -0.0344 C.ar 1 UNL1111111111 0.2271 19 C 0.0962 2.8243 0.1225 C.ar 1 UNL1111111111 -0.1769 20 C 4.4882 1.9406 0.1696 C.3 1 UNL1111111111 0.1572 21 C -2.2980 3.0811 0.0537 C.ar 1 UNL1111111111 -0.2212 22 C -1.0192 3.6412 0.1426 C.ar 1 UNL1111111111 -0.1063 23 C -3.2991 -1.4236 1.1213 C.3 1 UNL1111111111 -0.0116 24 C -4.5382 -2.2445 0.8005 C.3 1 UNL1111111111 -0.4562 25 C -4.1991 0.9083 -1.3309 C.3 1 UNL1111111111 -0.1805 26 H -0.9053 -3.4574 -0.2834 H 1 UNL1111111111 0.3335 27 H 4.0904 -2.1709 -0.0865 H 1 UNL1111111111 0.1892 28 H 1.0919 3.2663 0.1760 H 1 UNL1111111111 0.1713 29 H 4.8642 2.3028 1.1364 H 1 UNL1111111111 0.1424 30 H 4.9113 2.4155 -0.7264 H 1 UNL1111111111 0.1425 31 H -3.1846 3.7113 0.0568 H 1 UNL1111111111 0.1693 32 H -0.9086 4.7220 0.2201 H 1 UNL1111111111 0.1525 33 H -2.5831 -1.9668 1.7611 H 1 UNL1111111111 0.1212 34 H -3.5422 -0.4450 1.5730 H 1 UNL1111111111 0.1409 35 H -5.0922 -2.4937 1.7120 H 1 UNL1111111111 0.1527 36 H -5.2148 -1.6928 0.1363 H 1 UNL1111111111 0.1571 37 H -4.2786 -3.1811 0.2915 H 1 UNL1111111111 0.1554 38 H -5.1854 0.4769 -1.1243 H 1 UNL1111111111 0.1449 39 H -3.5567 0.1710 -1.8262 H 1 UNL1111111111 0.1474 40 H -4.2838 1.8230 -1.9244 H 1 UNL1111111111 0.1230 @BOND 1 1 14 1 2 1 20 1 3 2 15 1 4 2 20 1 5 3 13 1 6 3 23 1 7 4 18 1 8 4 25 1 9 5 17 2 10 6 9 ar 11 6 17 ar 12 6 26 1 13 7 8 ar 14 7 9 ar 15 7 11 ar 16 8 10 ar 17 8 14 ar 18 9 13 ar 19 10 12 ar 20 10 19 ar 21 11 16 ar 22 11 17 ar 23 12 13 ar 24 12 18 ar 25 14 15 ar 26 15 16 ar 27 16 27 1 28 18 21 ar 29 19 22 ar 30 19 28 1 31 20 29 1 32 20 30 1 33 21 22 ar 34 21 31 1 35 22 32 1 36 23 24 1 37 23 33 1 38 23 34 1 39 24 35 1 40 24 36 1 41 24 37 1 42 25 38 1 43 25 39 1 44 25 40 1