@MOLECULE n-{3-chloro-4-[(12as)-3,4,12,12a-tetrahydro-1h-[1,4]oxazino[3,4-c][1,4]benzodiazepin-11(6h)-ylcarbonyl]phenyl}-2-biphenylcarboxamide 67 72 0 0 0 SMALL GASTEIGER @ATOM 1 CL 1.2708 2.7578 -1.8836 Cl 1 UNL1111 -0.0651 2 O 0.9907 -3.5559 0.2850 O.3 1 UNL1111 -0.3824 3 O 3.2346 2.5736 1.2587 O.2 1 UNL1111 -0.4787 4 O -3.6105 0.6744 2.4361 O.2 1 UNL1111 -0.4660 5 N 3.5053 -2.2153 0.4931 N.3 1 UNL1111 -0.4150 6 N 3.2373 0.8116 -0.1565 N.am 1 UNL1111 -0.4950 7 N -3.0697 1.4341 0.3426 N.am 1 UNL1111 -0.5670 8 C 2.2526 -1.4619 0.2241 C.3 1 UNL1111 -0.0307 9 C 2.5511 -0.3190 -0.7813 C.3 1 UNL1111 -0.0846 10 C 4.4618 -1.4087 1.3044 C.3 1 UNL1111 -0.1212 11 C 1.2147 -2.3801 -0.4626 C.3 1 UNL1111 -0.0649 12 C 3.2019 -3.4695 1.2366 C.3 1 UNL1111 -0.1605 13 C 5.2557 -0.4361 0.4726 C.ar 1 UNL1111 -0.0433 14 C 2.1841 -4.3009 0.4420 C.3 1 UNL1111 -0.0468 15 C 4.6587 0.6862 -0.1215 C.ar 1 UNL1111 0.1779 16 C 2.5945 1.7698 0.6189 C.2 1 UNL1111 0.5917 17 C 6.6379 -0.5897 0.3641 C.ar 1 UNL1111 -0.1530 18 C 5.4303 1.6739 -0.7421 C.ar 1 UNL1111 -0.1540 19 C 7.4102 0.3764 -0.2778 C.ar 1 UNL1111 -0.1564 20 C 6.8105 1.5150 -0.8130 C.ar 1 UNL1111 -0.1411 21 C 1.1087 1.7450 0.5811 C.ar 1 UNL1111 -0.2071 22 C 0.4018 2.1618 -0.5396 C.ar 1 UNL1111 0.1036 23 C 0.3975 1.3030 1.6978 C.ar 1 UNL1111 -0.0391 24 C -0.9761 2.0864 -0.6182 C.ar 1 UNL1111 -0.3045 25 C -0.9884 1.2155 1.6609 C.ar 1 UNL1111 -0.2390 26 C -1.6813 1.5788 0.4942 C.ar 1 UNL1111 0.2829 27 C -3.9405 0.8860 1.2950 C.2 1 UNL1111 0.5938 28 C -5.2962 0.5825 0.7593 C.ar 1 UNL1111 -0.1606 29 C -5.4569 -0.3676 -0.2553 C.ar 1 UNL1111 0.0192 30 C -4.2900 -1.0468 -0.8369 C.ar 1 UNL1111 -0.0457 31 C -6.4003 1.2197 1.3202 C.ar 1 UNL1111 -0.0832 32 C -6.7410 -0.6683 -0.7129 C.ar 1 UNL1111 -0.1659 33 C -7.6783 0.9174 0.8547 C.ar 1 UNL1111 -0.1639 34 C -7.8461 -0.0248 -0.1593 C.ar 1 UNL1111 -0.1057 35 C -3.9213 -0.7837 -2.1580 C.ar 1 UNL1111 -0.1679 36 C -3.5385 -1.9328 -0.0611 C.ar 1 UNL1111 -0.1399 37 C -2.7931 -1.3978 -2.6962 C.ar 1 UNL1111 -0.1369 38 C -2.4154 -2.5494 -0.6066 C.ar 1 UNL1111 -0.1308 39 C -2.0424 -2.2817 -1.9228 C.ar 1 UNL1111 -0.1450 40 H 1.8079 -1.0451 1.1626 H 1 UNL1111 0.1368 41 H 3.1929 -0.7149 -1.6077 H 1 UNL1111 0.1706 42 H 1.6067 0.0265 -1.2558 H 1 UNL1111 0.1524 43 H 3.9490 -0.8437 2.1207 H 1 UNL1111 0.1388 44 H 5.1664 -2.1082 1.8145 H 1 UNL1111 0.1442 45 H 1.5271 -2.6511 -1.4868 H 1 UNL1111 0.1288 46 H 0.2147 -1.9065 -0.4821 H 1 UNL1111 0.1463 47 H 2.8073 -3.2747 2.2573 H 1 UNL1111 0.1294 48 H 4.1483 -4.0428 1.3427 H 1 UNL1111 0.1442 49 H 2.5775 -4.5971 -0.5463 H 1 UNL1111 0.1317 50 H 1.8514 -5.1945 0.9972 H 1 UNL1111 0.1360 51 H 7.1206 -1.4685 0.7882 H 1 UNL1111 0.1518 52 H 4.9453 2.5577 -1.1570 H 1 UNL1111 0.1744 53 H 8.4875 0.2442 -0.3522 H 1 UNL1111 0.1503 54 H 7.4197 2.2806 -1.2900 H 1 UNL1111 0.1528 55 H 0.9363 1.0210 2.6061 H 1 UNL1111 0.1684 56 H -1.5049 2.4064 -1.5126 H 1 UNL1111 0.1759 57 H -1.5274 0.8583 2.5432 H 1 UNL1111 0.2084 58 H -3.4434 1.6063 -0.5905 H 1 UNL1111 0.3197 59 H -6.2622 1.9451 2.1242 H 1 UNL1111 0.1674 60 H -6.8739 -1.4115 -1.4984 H 1 UNL1111 0.1639 61 H -8.5455 1.4133 1.2871 H 1 UNL1111 0.1570 62 H -8.8466 -0.2629 -0.5198 H 1 UNL1111 0.1531 63 H -4.5156 -0.1033 -2.7638 H 1 UNL1111 0.1520 64 H -3.8287 -2.1357 0.9702 H 1 UNL1111 0.1664 65 H -2.4999 -1.1888 -3.7233 H 1 UNL1111 0.1504 66 H -1.8248 -3.2406 -0.0014 H 1 UNL1111 0.1676 67 H -1.1679 -2.7710 -2.3495 H 1 UNL1111 0.1535 @BOND 1 1 22 1 2 2 11 1 3 2 14 1 4 3 16 2 5 4 27 2 6 5 8 1 7 5 10 1 8 5 12 1 9 6 9 1 10 6 15 1 11 6 16 am 12 7 26 1 13 7 27 am 14 7 58 1 15 8 9 1 16 8 11 1 17 8 40 1 18 9 41 1 19 9 42 1 20 10 13 1 21 10 43 1 22 10 44 1 23 11 45 1 24 11 46 1 25 12 14 1 26 12 47 1 27 12 48 1 28 13 15 ar 29 13 17 ar 30 14 49 1 31 14 50 1 32 15 18 ar 33 16 21 1 34 17 19 ar 35 17 51 1 36 18 20 ar 37 18 52 1 38 19 20 ar 39 19 53 1 40 20 54 1 41 21 22 ar 42 21 23 ar 43 22 24 ar 44 23 25 ar 45 23 55 1 46 24 26 ar 47 24 56 1 48 25 26 ar 49 25 57 1 50 27 28 1 51 28 29 ar 52 28 31 ar 53 29 30 1 54 29 32 ar 55 30 35 ar 56 30 36 ar 57 31 33 ar 58 31 59 1 59 32 34 ar 60 32 60 1 61 33 34 ar 62 33 61 1 63 34 62 1 64 35 37 ar 65 35 63 1 66 36 38 ar 67 36 64 1 68 37 39 ar 69 37 65 1 70 38 39 ar 71 38 66 1 72 39 67 1