@MOLECULE 3,4-dimethyl-1-propyl-7-(2-quinolinylmethoxy)imidazo[1,5-a]quinoxaline 54 58 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 C -3.6066 4.6135 -0.6733 C.3 1 UNL1 -0.4354 2 C -4.1473 3.2008 -0.8764 C.3 1 UNL1 -0.2420 3 C -4.6000 2.5932 0.4623 C.3 1 UNL1 -0.2704 4 C -4.8852 1.1469 0.3110 C.ar 1 UNL1 0.2190 5 N -6.1460 0.6515 0.2484 N.ar 1 UNL1 -0.4194 6 C -6.0702 -0.7115 0.0804 C.ar 1 UNL1 0.1609 7 C -4.7174 -1.0921 0.0357 C.ar 1 UNL1 -0.1790 8 N -3.9691 0.1071 0.1930 N.ar 1 UNL1 -0.1974 9 C -2.5646 0.0579 0.1945 C.ar 1 UNL1 -0.0037 10 C -1.7505 1.1792 0.3902 C.ar 1 UNL1 -0.1116 11 C -0.3688 1.0661 0.3562 C.ar 1 UNL1 -0.2742 12 C 0.2097 -0.1886 0.1288 C.ar 1 UNL1 0.2627 13 C -0.5677 -1.3331 -0.0492 C.ar 1 UNL1 -0.2326 14 C -1.9611 -1.2208 -0.0107 C.ar 1 UNL1 0.1857 15 N -2.7056 -2.3910 -0.1701 N.ar 1 UNL1 -0.4328 16 C -4.0123 -2.3328 -0.1391 C.ar 1 UNL1 0.3036 17 C -4.7833 -3.5991 -0.2961 C.3 1 UNL1 -0.4488 18 O 1.5428 -0.4424 0.0609 O.3 1 UNL1 -0.3259 19 C 2.4214 0.6726 0.2232 C.3 1 UNL1 -0.0522 20 C 3.8109 0.1018 0.0927 C.ar 1 UNL1 0.1816 21 C 4.0322 -1.2944 -0.0985 C.ar 1 UNL1 -0.2209 22 C 5.3221 -1.7431 -0.2071 C.ar 1 UNL1 -0.0900 23 C 6.3997 -0.8192 -0.1267 C.ar 1 UNL1 -0.0939 24 C 7.7609 -1.2079 -0.2305 C.ar 1 UNL1 -0.1318 25 C 8.7553 -0.2677 -0.1459 C.ar 1 UNL1 -0.1555 26 C 8.4407 1.1027 0.0476 C.ar 1 UNL1 -0.1303 27 C 7.1383 1.5131 0.1526 C.ar 1 UNL1 -0.1530 28 C 6.0888 0.5511 0.0655 C.ar 1 UNL1 0.1633 29 N 4.7906 0.9897 0.1717 N.ar 1 UNL1 -0.4102 30 C -7.2818 -1.5433 -0.0251 C.3 1 UNL1 -0.4262 31 H -3.3180 5.0658 -1.6297 H 1 UNL1 0.1446 32 H -4.3564 5.2697 -0.2164 H 1 UNL1 0.1452 33 H -2.7205 4.6222 -0.0292 H 1 UNL1 0.1401 34 H -5.0017 3.2123 -1.5831 H 1 UNL1 0.1521 35 H -3.3806 2.5628 -1.3574 H 1 UNL1 0.1430 36 H -3.8574 2.7783 1.2656 H 1 UNL1 0.1586 37 H -5.5288 3.1103 0.8078 H 1 UNL1 0.1852 38 H -2.1910 2.1596 0.5752 H 1 UNL1 0.1721 39 H 0.2418 1.9517 0.5070 H 1 UNL1 0.1717 40 H -0.1063 -2.3081 -0.2152 H 1 UNL1 0.1992 41 H -5.4210 -3.5680 -1.1922 H 1 UNL1 0.1704 42 H -4.1145 -4.4722 -0.3997 H 1 UNL1 0.1856 43 H -5.4295 -3.7828 0.5751 H 1 UNL1 0.1701 44 H 2.2221 1.4234 -0.5681 H 1 UNL1 0.1597 45 H 2.2699 1.1244 1.2244 H 1 UNL1 0.1585 46 H 3.1807 -1.9730 -0.1548 H 1 UNL1 0.1909 47 H 5.5414 -2.8008 -0.3548 H 1 UNL1 0.1627 48 H 7.9956 -2.2613 -0.3777 H 1 UNL1 0.1570 49 H 9.8024 -0.5566 -0.2256 H 1 UNL1 0.1564 50 H 9.2564 1.8227 0.1109 H 1 UNL1 0.1563 51 H 6.8684 2.5589 0.3014 H 1 UNL1 0.1749 52 H -7.3331 -2.0672 -0.9917 H 1 UNL1 0.1624 53 H -7.3289 -2.2964 0.7760 H 1 UNL1 0.1623 54 H -8.1967 -0.9281 0.0574 H 1 UNL1 0.1810 @BOND 1 31 1 1 2 34 2 1 3 35 2 1 4 41 17 1 5 52 30 1 6 2 1 1 7 2 3 1 8 1 32 1 9 1 33 1 10 44 19 1 11 42 17 1 12 48 24 1 13 47 22 1 14 17 16 1 15 17 43 1 16 24 25 ar 17 24 23 ar 18 49 25 1 19 40 13 1 20 22 23 ar 21 22 21 ar 22 15 16 ar 23 15 14 ar 24 46 21 1 25 25 26 ar 26 16 7 ar 27 23 28 ar 28 21 20 ar 29 13 14 ar 30 13 12 ar 31 30 54 1 32 30 6 1 33 30 53 1 34 14 9 ar 35 7 6 ar 36 7 8 ar 37 26 50 1 38 26 27 ar 39 18 12 1 40 18 19 1 41 28 27 ar 42 28 29 ar 43 6 5 ar 44 20 29 ar 45 20 19 1 46 12 11 ar 47 27 51 1 48 8 9 ar 49 8 4 ar 50 9 10 ar 51 19 45 1 52 5 4 ar 53 4 3 1 54 11 10 ar 55 11 39 1 56 10 38 1 57 3 37 1 58 3 36 1