@MOLECULE 1-cyanocyclohexyl (3s,5'r)-2-oxo-1,2-dihydrospiro[indole-3,3'-pyrrolidine]-5'-carboxylate 46 49 0 0 0 SMALL GASTEIGER @ATOM 1 C 3.4732 -0.8214 -1.2154 C.1 1 UNL1111111111 0.0575 2 C -4.4026 2.6778 0.4420 C.ar 1 UNL1111111111 -0.2118 3 C -5.4436 2.2764 -0.3901 C.ar 1 UNL1111111111 -0.0784 4 C -3.3310 1.8175 0.7211 C.ar 1 UNL1111111111 -0.0836 5 C -5.4623 1.0040 -0.9732 C.ar 1 UNL1111111111 -0.2472 6 C -3.3312 0.5609 0.1569 C.ar 1 UNL1111111111 -0.1374 7 C -4.4015 0.1582 -0.6874 C.ar 1 UNL1111111111 0.2022 8 C -2.9836 -1.6668 -0.5959 C.2 1 UNL1111111111 0.5560 9 C 1.3363 -0.6004 0.7366 C.2 1 UNL1111111111 0.5770 10 C 6.0399 1.4772 0.0870 C.3 1 UNL1111111111 -0.2682 11 C 5.7337 0.0985 0.6832 C.3 1 UNL1111111111 -0.2608 12 C 5.2067 1.7119 -1.1786 C.3 1 UNL1111111111 -0.2660 13 C 4.2450 -0.0417 1.0120 C.3 1 UNL1111111111 -0.3210 14 C 3.7117 1.6165 -0.8660 C.3 1 UNL1111111111 -0.2950 15 C -0.9422 -0.1984 -0.2434 C.3 1 UNL1111111111 -0.2959 16 C -2.1471 -1.0484 1.7355 C.3 1 UNL1111111111 -0.1032 17 C -0.0732 -0.1305 1.0349 C.3 1 UNL1111111111 -0.0137 18 C 3.3858 0.2527 -0.2241 C.3 1 UNL1111111111 0.3228 19 C -2.3414 -0.5634 0.2732 C.3 1 UNL1111111111 -0.0545 20 N 3.5559 -1.6526 -2.0131 N.1 1 UNL1111111111 -0.2165 21 N -4.1882 -1.1606 -1.1277 N.am 1 UNL1111111111 -0.5718 22 N -0.7017 -0.9957 2.0612 N.3 1 UNL1111111111 -0.5119 23 O -2.5890 -2.7773 -0.8186 O.2 1 UNL1111111111 -0.4488 24 O 1.8155 -1.6804 0.9426 O.2 1 UNL1111111111 -0.4711 25 O 2.0151 0.4261 0.1635 O.3 1 UNL1111111111 -0.4647 26 H -4.4176 3.6713 0.8837 H 1 UNL1111111111 0.1545 27 H -6.2652 2.9636 -0.5946 H 1 UNL1111111111 0.1504 28 H -2.5198 2.1387 1.3728 H 1 UNL1111111111 0.1597 29 H -6.2777 0.6988 -1.6198 H 1 UNL1111111111 0.1668 30 H 5.8334 2.2690 0.8315 H 1 UNL1111111111 0.1399 31 H 7.1176 1.5571 -0.1489 H 1 UNL1111111111 0.1393 32 H 6.0435 -0.6983 -0.0222 H 1 UNL1111111111 0.1487 33 H 6.3348 -0.0637 1.5985 H 1 UNL1111111111 0.1435 34 H 5.4380 2.7042 -1.6099 H 1 UNL1111111111 0.1415 35 H 5.4839 0.9744 -1.9580 H 1 UNL1111111111 0.1488 36 H 4.0333 -1.0615 1.3989 H 1 UNL1111111111 0.1778 37 H 3.9613 0.6539 1.8262 H 1 UNL1111111111 0.1618 38 H 3.4071 2.4243 -0.1706 H 1 UNL1111111111 0.1641 39 H 3.1056 1.7643 -1.7802 H 1 UNL1111111111 0.1576 40 H -0.9348 0.7569 -0.7950 H 1 UNL1111111111 0.1686 41 H -0.5641 -0.9635 -0.9511 H 1 UNL1111111111 0.1768 42 H -2.6729 -0.3684 2.4427 H 1 UNL1111111111 0.1600 43 H -2.5570 -2.0651 1.8958 H 1 UNL1111111111 0.1518 44 H -0.0499 0.9149 1.4455 H 1 UNL1111111111 0.1799 45 H -4.8073 -1.6638 -1.7301 H 1 UNL1111111111 0.3338 46 H -0.2805 -1.9296 2.0647 H 1 UNL1111111111 0.2809 @BOND 1 1 20 3 2 2 3 ar 3 2 26 1 4 3 5 ar 5 3 27 1 6 4 2 ar 7 4 6 ar 8 4 28 1 9 5 29 1 10 6 19 1 11 6 7 ar 12 7 5 ar 13 7 21 1 14 8 21 am 15 8 23 2 16 9 25 1 17 9 24 2 18 10 11 1 19 10 30 1 20 10 31 1 21 11 32 1 22 11 33 1 23 12 10 1 24 12 34 1 25 12 35 1 26 13 11 1 27 13 36 1 28 13 37 1 29 14 18 1 30 14 12 1 31 14 38 1 32 14 39 1 33 15 19 1 34 15 40 1 35 15 41 1 36 16 19 1 37 16 42 1 38 16 43 1 39 17 15 1 40 17 9 1 41 17 44 1 42 18 13 1 43 18 1 1 44 19 8 1 45 21 45 1 46 22 17 1 47 22 16 1 48 22 46 1 49 25 18 1