@MOLECULE n-cyclohexyl-1-isopropyl-6-methylergoline-8-carboxamide 64 68 0 0 0 SMALL GASTEIGER @ATOM 1 O -3.0099 1.3785 1.9037 O.2 1 UNL1111111111 -0.5426 2 N 0.0517 3.3309 -0.1762 N.3 1 UNL1111111111 -0.4185 3 N 4.3392 -0.7847 0.5004 N.ar 1 UNL1111111111 -0.3119 4 N -3.8493 0.2656 0.1251 N.am 1 UNL1111111111 -0.6179 5 C 0.3912 1.0485 -1.2304 C.3 1 UNL1111111111 -0.1622 6 C 1.0363 2.2733 -0.4894 C.3 1 UNL1111111111 0.0638 7 C -0.7962 0.4990 -0.4242 C.3 1 UNL1111111111 -0.2630 8 C -1.8187 1.6145 -0.1792 C.3 1 UNL1111111111 -0.2444 9 C 1.7708 1.9066 0.8388 C.3 1 UNL1111111111 -0.2625 10 C 1.3956 -0.0477 -1.4241 C.ar 1 UNL1111111111 0.0466 11 C -1.1345 2.8124 0.5238 C.3 1 UNL1111111111 -0.0935 12 C 2.4459 -0.0825 -0.5077 C.ar 1 UNL1111111111 -0.1242 13 C 2.7135 0.8029 0.5842 C.ar 1 UNL1111111111 -0.0982 14 C 3.4701 -1.0685 -0.5493 C.ar 1 UNL1111111111 0.1202 15 C -2.9180 1.0879 0.7278 C.2 1 UNL1111111111 0.5724 16 C 3.8739 0.3547 1.1856 C.ar 1 UNL1111111111 -0.0506 17 C -0.3141 4.1137 -1.3746 C.3 1 UNL1111111111 -0.2750 18 C 1.3697 -1.0263 -2.3992 C.ar 1 UNL1111111111 -0.2339 19 C -4.8750 -0.4038 0.9409 C.3 1 UNL1111111111 0.1105 20 C 3.4324 -2.0598 -1.5445 C.ar 1 UNL1111111111 -0.2310 21 C 5.5357 -1.5491 0.8457 C.3 1 UNL1111111111 0.1310 22 C -6.1373 -0.6455 0.0873 C.3 1 UNL1111111111 -0.3048 23 C -4.3377 -1.7306 1.5220 C.3 1 UNL1111111111 -0.3072 24 C 2.3831 -2.0141 -2.4455 C.ar 1 UNL1111111111 -0.0964 25 C -5.9302 -1.7304 -0.9761 C.3 1 UNL1111111111 -0.2597 26 C -4.1283 -2.7900 0.4367 C.3 1 UNL1111111111 -0.2573 27 C -5.4283 -3.0322 -0.3397 C.3 1 UNL1111111111 -0.2687 28 C 5.3969 -2.1369 2.2583 C.3 1 UNL1111111111 -0.4755 29 C 6.7809 -0.6550 0.7439 C.3 1 UNL1111111111 -0.4756 30 H 0.0294 1.4074 -2.2244 H 1 UNL1111111111 0.1450 31 H 1.8080 2.7074 -1.1787 H 1 UNL1111111111 0.1391 32 H -1.2533 -0.3535 -0.9579 H 1 UNL1111111111 0.1384 33 H -0.4311 0.0899 0.5414 H 1 UNL1111111111 0.1660 34 H -2.2505 1.9567 -1.1473 H 1 UNL1111111111 0.1544 35 H 1.0364 1.6115 1.6184 H 1 UNL1111111111 0.1646 36 H 2.2721 2.8138 1.2308 H 1 UNL1111111111 0.1609 37 H -1.8641 3.6366 0.6697 H 1 UNL1111111111 0.1437 38 H -0.8188 2.5115 1.5517 H 1 UNL1111111111 0.1676 39 H 4.4037 0.7423 2.0321 H 1 UNL1111111111 0.1645 40 H -0.9758 4.9424 -1.0727 H 1 UNL1111111111 0.1436 41 H -0.8171 3.5376 -2.1643 H 1 UNL1111111111 0.1166 42 H 0.5967 4.5679 -1.7992 H 1 UNL1111111111 0.1434 43 H 0.5782 -1.0509 -3.1405 H 1 UNL1111111111 0.1520 44 H -5.1332 0.2839 1.7954 H 1 UNL1111111111 0.1581 45 H -3.7289 -0.0714 -0.8137 H 1 UNL1111111111 0.3073 46 H 4.1943 -2.8265 -1.6027 H 1 UNL1111111111 0.1515 47 H 5.6286 -2.3921 0.1055 H 1 UNL1111111111 0.1436 48 H -6.4515 0.3015 -0.3909 H 1 UNL1111111111 0.1448 49 H -6.9670 -0.9363 0.7594 H 1 UNL1111111111 0.1452 50 H -5.0462 -2.1025 2.2844 H 1 UNL1111111111 0.1410 51 H -3.3885 -1.5368 2.0597 H 1 UNL1111111111 0.1558 52 H 2.3270 -2.7660 -3.2326 H 1 UNL1111111111 0.1441 53 H -5.2177 -1.3864 -1.7474 H 1 UNL1111111111 0.1288 54 H -6.8809 -1.9138 -1.5115 H 1 UNL1111111111 0.1315 55 H -3.7784 -3.7340 0.8947 H 1 UNL1111111111 0.1334 56 H -3.3238 -2.4759 -0.2539 H 1 UNL1111111111 0.1360 57 H -6.2006 -3.4426 0.3374 H 1 UNL1111111111 0.1372 58 H -5.2694 -3.7994 -1.1189 H 1 UNL1111111111 0.1296 59 H 5.3315 -1.3538 3.0221 H 1 UNL1111111111 0.1567 60 H 6.2538 -2.7721 2.5048 H 1 UNL1111111111 0.1530 61 H 4.4894 -2.7482 2.3455 H 1 UNL1111111111 0.1617 62 H 6.8624 -0.2019 -0.2526 H 1 UNL1111111111 0.1612 63 H 7.6937 -1.2318 0.9253 H 1 UNL1111111111 0.1532 64 H 6.7552 0.1656 1.4695 H 1 UNL1111111111 0.1563 @BOND 1 1 15 2 2 2 6 1 3 2 11 1 4 2 17 1 5 3 14 ar 6 3 16 ar 7 3 21 1 8 4 15 am 9 4 19 1 10 4 45 1 11 5 6 1 12 5 7 1 13 5 10 1 14 5 30 1 15 6 9 1 16 6 31 1 17 7 8 1 18 7 32 1 19 7 33 1 20 8 11 1 21 8 15 1 22 8 34 1 23 9 13 1 24 9 35 1 25 9 36 1 26 10 12 ar 27 10 18 ar 28 11 37 1 29 11 38 1 30 12 13 ar 31 12 14 ar 32 13 16 ar 33 14 20 ar 34 16 39 1 35 17 40 1 36 17 41 1 37 17 42 1 38 18 24 ar 39 18 43 1 40 19 22 1 41 19 23 1 42 19 44 1 43 20 24 ar 44 20 46 1 45 21 28 1 46 21 29 1 47 21 47 1 48 22 25 1 49 22 48 1 50 22 49 1 51 23 26 1 52 23 50 1 53 23 51 1 54 24 52 1 55 25 27 1 56 25 53 1 57 25 54 1 58 26 27 1 59 26 55 1 60 26 56 1 61 27 57 1 62 27 58 1 63 28 59 1 64 28 60 1 65 28 61 1 66 29 62 1 67 29 63 1 68 29 64 1