@MOLECULE (8beta)-n-(4-hydroxycyclohexyl)-1-isopropyl-6-methylergoline-8-carboxamide 65 69 0 0 0 SMALL GASTEIGER @ATOM 1 O 3.1034 -2.0532 1.5828 O.2 1 UNL1111111111 -0.5446 2 O 6.1090 3.3008 -1.0827 O.3 1 UNL1111111111 -0.5649 3 N -0.4344 -2.9486 -0.5569 N.3 1 UNL1111111111 -0.4248 4 N -5.1256 0.7594 -0.0080 N.ar 1 UNL1111111111 -0.3100 5 N 3.8878 -0.7563 -0.0924 N.am 1 UNL1111111111 -0.6196 6 C -0.6545 -0.4923 -0.4983 C.3 1 UNL1111111111 -0.1275 7 C -1.3356 -1.8522 -0.0989 C.3 1 UNL1111111111 0.0601 8 C 0.7182 -0.3777 0.1755 C.3 1 UNL1111111111 -0.2720 9 C 1.5783 -1.5803 -0.2249 C.3 1 UNL1111111111 -0.2058 10 C -2.7384 -2.0131 -0.7621 C.3 1 UNL1111111111 -0.2757 11 C -1.5329 0.6714 -0.1404 C.ar 1 UNL1111111111 0.0491 12 C 0.8615 -2.8856 0.1680 C.3 1 UNL1111111111 -0.1072 13 C -2.9028 0.4047 -0.1659 C.ar 1 UNL1111111111 -0.1295 14 C -3.5634 -0.8319 -0.4480 C.ar 1 UNL1111111111 -0.1056 15 C -3.8894 1.3889 0.1105 C.ar 1 UNL1111111111 0.1232 16 C 2.8988 -1.5015 0.5206 C.2 1 UNL1111111111 0.5709 17 C -4.9206 -0.5920 -0.3450 C.ar 1 UNL1111111111 -0.0493 18 C -1.0322 -4.2878 -0.3576 C.3 1 UNL1111111111 -0.2779 19 C -1.1514 1.9636 0.1688 C.ar 1 UNL1111111111 -0.2310 20 C 5.1622 -0.5120 0.5968 C.3 1 UNL1111111111 0.1032 21 C 5.0775 0.7577 1.4748 C.3 1 UNL1111111111 -0.3046 22 C 6.3018 -0.3943 -0.4382 C.3 1 UNL1111111111 -0.3008 23 C -3.4865 2.6983 0.4244 C.ar 1 UNL1111111111 -0.2336 24 C -6.4265 1.3897 0.2047 C.3 1 UNL1111111111 0.1307 25 C -2.1270 2.9518 0.4467 C.ar 1 UNL1111111111 -0.0960 26 C 4.9830 2.0333 0.6385 C.3 1 UNL1111111111 -0.3276 27 C 6.2261 0.8962 -1.2561 C.3 1 UNL1111111111 -0.3299 28 C 6.1775 2.1146 -0.3219 C.3 1 UNL1111111111 0.1673 29 C -7.1543 0.7168 1.3785 C.3 1 UNL1111111111 -0.4756 30 C -7.2669 1.3118 -1.0788 C.3 1 UNL1111111111 -0.4754 31 H -0.5257 -0.5011 -1.6129 H 1 UNL1111111111 0.1696 32 H -1.4725 -1.8617 1.0120 H 1 UNL1111111111 0.1257 33 H 1.2107 0.5676 -0.1178 H 1 UNL1111111111 0.1400 34 H 0.5982 -0.3340 1.2769 H 1 UNL1111111111 0.1604 35 H 1.7373 -1.5839 -1.3308 H 1 UNL1111111111 0.1683 36 H -3.2259 -2.9419 -0.4099 H 1 UNL1111111111 0.1486 37 H -2.6146 -2.1214 -1.8613 H 1 UNL1111111111 0.1670 38 H 1.4833 -3.7556 -0.1350 H 1 UNL1111111111 0.1421 39 H 0.7496 -2.9435 1.2738 H 1 UNL1111111111 0.1413 40 H -5.7488 -1.2574 -0.4808 H 1 UNL1111111111 0.1635 41 H -0.2787 -5.0658 -0.5650 H 1 UNL1111111111 0.1418 42 H -1.8374 -4.4322 -1.0969 H 1 UNL1111111111 0.1463 43 H -1.4367 -4.4585 0.6510 H 1 UNL1111111111 0.1225 44 H -0.1041 2.2462 0.2044 H 1 UNL1111111111 0.1531 45 H 5.3651 -1.3959 1.2672 H 1 UNL1111111111 0.1630 46 H 3.7109 -0.2203 -0.9228 H 1 UNL1111111111 0.3074 47 H 4.2038 0.6753 2.1519 H 1 UNL1111111111 0.1598 48 H 5.9618 0.7992 2.1378 H 1 UNL1111111111 0.1447 49 H 7.2714 -0.4455 0.0946 H 1 UNL1111111111 0.1482 50 H 6.2850 -1.2729 -1.1122 H 1 UNL1111111111 0.1515 51 H -4.2105 3.4733 0.6392 H 1 UNL1111111111 0.1518 52 H -6.2441 2.4715 0.4583 H 1 UNL1111111111 0.1447 53 H -1.7788 3.9566 0.6878 H 1 UNL1111111111 0.1447 54 H 4.0315 2.0636 0.0791 H 1 UNL1111111111 0.1406 55 H 4.9713 2.9262 1.2927 H 1 UNL1111111111 0.1529 56 H 7.1043 0.9798 -1.9257 H 1 UNL1111111111 0.1532 57 H 5.3496 0.8900 -1.9266 H 1 UNL1111111111 0.1355 58 H 7.1374 2.2495 0.2262 H 1 UNL1111111111 0.1420 59 H -7.3822 -0.3343 1.1697 H 1 UNL1111111111 0.1558 60 H -8.0987 1.2254 1.5978 H 1 UNL1111111111 0.1538 61 H -6.5415 0.7390 2.2892 H 1 UNL1111111111 0.1621 62 H -6.7319 1.7530 -1.9298 H 1 UNL1111111111 0.1615 63 H -8.2124 1.8515 -0.9616 H 1 UNL1111111111 0.1539 64 H -7.5051 0.2773 -1.3492 H 1 UNL1111111111 0.1556 65 H 5.2997 3.3382 -1.6234 H 1 UNL1111111111 0.3114 @BOND 1 1 16 2 2 2 28 1 3 2 65 1 4 3 7 1 5 3 12 1 6 3 18 1 7 4 15 ar 8 4 17 ar 9 4 24 1 10 5 16 am 11 5 20 1 12 5 46 1 13 6 7 1 14 6 8 1 15 6 11 1 16 6 31 1 17 7 10 1 18 7 32 1 19 8 9 1 20 8 33 1 21 8 34 1 22 9 12 1 23 9 16 1 24 9 35 1 25 10 14 1 26 10 36 1 27 10 37 1 28 11 13 ar 29 11 19 ar 30 12 38 1 31 12 39 1 32 13 14 ar 33 13 15 ar 34 14 17 ar 35 15 23 ar 36 17 40 1 37 18 41 1 38 18 42 1 39 18 43 1 40 19 25 ar 41 19 44 1 42 20 21 1 43 20 22 1 44 20 45 1 45 21 26 1 46 21 47 1 47 21 48 1 48 22 27 1 49 22 49 1 50 22 50 1 51 23 25 ar 52 23 51 1 53 24 29 1 54 24 30 1 55 24 52 1 56 25 53 1 57 26 28 1 58 26 54 1 59 26 55 1 60 27 28 1 61 27 56 1 62 27 57 1 63 28 58 1 64 29 59 1 65 29 60 1 66 29 61 1 67 30 62 1 68 30 63 1 69 30 64 1