@MOLECULE n-[4-(4-oxo-1,4-dihydro-2-quinazolinyl)phenyl]-2-thiophenecarboxamide 38 41 0 0 0 SMALL MULLIKEN_CHARGES @ATOM 1 O 3.7242 -1.0675 -1.3226 O.2 1 UNL1 -0.4648 2 C 4.0202 -0.3743 -0.3787 C.2 1 UNL1 0.6083 3 C 5.3981 -0.0999 0.0465 C.ar 1 UNL1 -0.3283 4 C 5.9433 -0.3419 1.2822 C.ar 1 UNL1 -0.1180 5 C 7.3271 0.0084 1.3524 C.ar 1 UNL1 -0.1823 6 N 3.0571 0.2521 0.4239 N.am 1 UNL1 -0.5730 7 C 1.6619 0.1439 0.2658 C.ar 1 UNL1 0.2632 8 C 0.8661 1.0054 1.0485 C.ar 1 UNL1 -0.2779 9 C -0.5164 0.9296 0.9689 C.ar 1 UNL1 -0.0275 10 C 1.0557 -0.7770 -0.6022 C.ar 1 UNL1 -0.2304 11 C -0.3297 -0.8468 -0.6679 C.ar 1 UNL1 -0.0688 12 C -1.1176 -0.0101 0.1263 C.ar 1 UNL1 -0.1371 13 C -2.5881 -0.0938 0.0774 C.ar 1 UNL1 0.4172 14 N -3.1485 -1.3658 0.2334 N.ar 1 UNL1 -0.5826 15 C -4.5552 -1.5615 0.2161 C.ar 1 UNL1 0.5900 16 O -4.9629 -2.6907 0.3650 O.2 1 UNL1 -0.4840 17 C 7.8131 0.5087 0.1736 C.ar 1 UNL1 -0.2757 18 N -3.3106 0.9874 -0.0871 N.ar 1 UNL1 -0.4823 19 C -4.6994 0.8873 -0.1235 C.ar 1 UNL1 0.2360 20 C -5.3511 -0.3538 0.0214 C.ar 1 UNL1 -0.2488 21 C -5.4602 2.0598 -0.3130 C.ar 1 UNL1 -0.1934 22 C -6.8391 1.9712 -0.3516 C.ar 1 UNL1 -0.0818 23 C -7.4880 0.7330 -0.2051 C.ar 1 UNL1 -0.2060 24 C -6.7504 -0.4230 -0.0196 C.ar 1 UNL1 -0.0461 25 S 6.5854 0.5386 -1.0381 S.2 1 UNL1 0.3672 26 H 3.3829 0.8646 1.1688 H 1 UNL1 0.3177 27 H 5.4112 -0.7640 2.1236 H 1 UNL1 0.1672 28 H 7.9072 -0.1201 2.2546 H 1 UNL1 0.1680 29 H 8.8186 0.8438 -0.0159 H 1 UNL1 0.1794 30 H 1.3278 1.7352 1.7083 H 1 UNL1 0.1606 31 H 1.6580 -1.4394 -1.2292 H 1 UNL1 0.2026 32 H -1.1405 1.6068 1.5586 H 1 UNL1 0.1709 33 H -0.7984 -1.5543 -1.3554 H 1 UNL1 0.1626 34 H -2.5515 -2.1759 0.3861 H 1 UNL1 0.3349 35 H -4.9425 3.0115 -0.4278 H 1 UNL1 0.1780 36 H -7.2389 -1.3947 0.0958 H 1 UNL1 0.1740 37 H -7.4380 2.8710 -0.4980 H 1 UNL1 0.1515 38 H -8.5745 0.6907 -0.2398 H 1 UNL1 0.1596 @BOND 1 33 11 1 2 1 2 2 3 31 10 1 4 25 3 ar 5 25 17 ar 6 11 10 ar 7 11 12 ar 8 10 7 ar 9 37 22 1 10 35 21 1 11 2 3 1 12 2 6 am 13 22 21 ar 14 22 23 ar 15 21 19 ar 16 38 23 1 17 23 24 ar 18 19 18 ar 19 19 20 ar 20 18 13 ar 21 24 20 ar 22 24 36 1 23 29 17 1 24 20 15 ar 25 3 4 ar 26 13 12 1 27 13 14 ar 28 12 9 ar 29 17 5 ar 30 15 14 ar 31 15 16 2 32 14 34 1 33 7 6 1 34 7 8 ar 35 6 26 1 36 9 8 ar 37 9 32 1 38 8 30 1 39 4 5 ar 40 4 27 1 41 5 28 1