@MOLECULE zosuquidar 70 76 0 0 0 SMALL GASTEIGER @ATOM 1 F -6.1079 -0.6343 -1.2584 F 1 UNL1111111111 -0.1583 2 F -5.5945 0.8496 -2.6615 F 1 UNL1111111111 -0.1735 3 O 3.6049 3.8508 -1.9020 O.3 1 UNL1111111111 -0.5726 4 O 4.4953 1.2301 -0.4969 O.3 1 UNL1111111111 -0.3613 5 N -1.4926 0.5424 0.2823 N.3 1 UNL1111111111 -0.4294 6 N 0.7499 2.2173 -0.3545 N.3 1 UNL1111111111 -0.4324 7 N 7.0884 -2.6396 0.4160 N.ar 1 UNL1111111111 -0.3917 8 C -3.6856 -0.2018 -1.5007 C.3 1 UNL1111111111 -0.2024 9 C -4.2763 0.8799 -0.5733 C.3 1 UNL1111111111 -0.2030 10 C -5.1366 0.1937 -1.6043 C.3 1 UNL1111111111 0.3170 11 C -3.3011 -1.5324 -0.9927 C.ar 1 UNL1111111111 0.0198 12 C -4.4826 0.6364 0.8671 C.ar 1 UNL1111111111 0.0209 13 C -2.2079 -0.5031 1.0705 C.3 1 UNL1111111111 0.0240 14 C -2.5738 -1.6834 0.1918 C.ar 1 UNL1111111111 -0.0270 15 C -3.4995 0.0320 1.6561 C.ar 1 UNL1111111111 -0.0270 16 C -3.6466 -2.6583 -1.7459 C.ar 1 UNL1111111111 -0.1520 17 C -5.6832 1.0548 1.4487 C.ar 1 UNL1111111111 -0.1518 18 C -0.2598 -0.0175 -0.3282 C.3 1 UNL1111111111 -0.1191 19 C -1.1320 1.6970 1.1430 C.3 1 UNL1111111111 -0.1190 20 C -2.1989 -2.9615 0.6125 C.ar 1 UNL1111111111 -0.1650 21 C -3.7275 -0.1466 3.0229 C.ar 1 UNL1111111111 -0.1667 22 C 0.3762 1.0721 -1.2205 C.3 1 UNL1111111111 -0.1167 23 C -0.4740 2.7866 0.2614 C.3 1 UNL1111111111 -0.1117 24 C -3.2732 -3.9286 -1.3189 C.ar 1 UNL1111111111 -0.1433 25 C -5.9076 0.8642 2.8083 C.ar 1 UNL1111111111 -0.1432 26 C -2.5475 -4.0801 -0.1387 C.ar 1 UNL1111111111 -0.1414 27 C -4.9270 0.2645 3.5968 C.ar 1 UNL1111111111 -0.1427 28 C 1.5071 3.2452 -1.1000 C.3 1 UNL1111111111 -0.1555 29 C 2.9419 2.7252 -1.3546 C.3 1 UNL1111111111 0.1410 30 C 3.6356 2.2898 -0.0577 C.3 1 UNL1111111111 -0.0946 31 C 5.1360 0.5177 0.4589 C.ar 1 UNL1111111111 0.2885 32 C 5.7376 -0.6710 -0.0585 C.ar 1 UNL1111111111 -0.1833 33 C 5.2462 0.8670 1.7850 C.ar 1 UNL1111111111 -0.3322 34 C 6.4782 -1.4815 0.8397 C.ar 1 UNL1111111111 0.2091 35 C 5.9890 0.0361 2.6573 C.ar 1 UNL1111111111 -0.0560 36 C 5.6207 -1.0834 -1.4091 C.ar 1 UNL1111111111 -0.0366 37 C 6.5967 -1.1077 2.2096 C.ar 1 UNL1111111111 -0.2316 38 C 6.2302 -2.2449 -1.8111 C.ar 1 UNL1111111111 -0.2771 39 C 6.9677 -2.9971 -0.8510 C.ar 1 UNL1111111111 0.0905 40 H -2.9786 0.1566 -2.2691 H 1 UNL1111111111 0.1929 41 H -3.9399 1.9140 -0.7638 H 1 UNL1111111111 0.1929 42 H -1.5454 -0.8620 1.9109 H 1 UNL1111111111 0.1307 43 H -4.2163 -2.5376 -2.6664 H 1 UNL1111111111 0.1598 44 H -6.4476 1.5235 0.8301 H 1 UNL1111111111 0.1602 45 H 0.4776 -0.3628 0.4282 H 1 UNL1111111111 0.1324 46 H -0.5323 -0.8935 -0.9551 H 1 UNL1111111111 0.1465 47 H -2.0593 2.1036 1.6005 H 1 UNL1111111111 0.1436 48 H -0.4441 1.4185 1.9695 H 1 UNL1111111111 0.1281 49 H -1.6349 -3.0895 1.5348 H 1 UNL1111111111 0.1525 50 H -2.9698 -0.6192 3.6455 H 1 UNL1111111111 0.1514 51 H -0.3292 1.3566 -2.0299 H 1 UNL1111111111 0.1274 52 H 1.2902 0.6620 -1.6986 H 1 UNL1111111111 0.1384 53 H -0.1885 3.6493 0.8986 H 1 UNL1111111111 0.1342 54 H -1.2053 3.1498 -0.4919 H 1 UNL1111111111 0.1278 55 H -3.5496 -4.8026 -1.9051 H 1 UNL1111111111 0.1504 56 H -6.8489 1.1793 3.2540 H 1 UNL1111111111 0.1506 57 H -2.2538 -5.0725 0.1968 H 1 UNL1111111111 0.1501 58 H -5.1003 0.1125 4.6599 H 1 UNL1111111111 0.1494 59 H 1.5677 4.1768 -0.4936 H 1 UNL1111111111 0.1575 60 H 1.0445 3.5347 -2.0670 H 1 UNL1111111111 0.1365 61 H 2.9598 1.9076 -2.1114 H 1 UNL1111111111 0.1358 62 H 4.2428 3.0980 0.3819 H 1 UNL1111111111 0.1446 63 H 2.9143 1.8971 0.6862 H 1 UNL1111111111 0.1722 64 H 4.5413 3.6398 -2.0902 H 1 UNL1111111111 0.3288 65 H 4.7850 1.7636 2.1842 H 1 UNL1111111111 0.1717 66 H 6.0714 0.3294 3.7052 H 1 UNL1111111111 0.1529 67 H 5.0443 -0.4699 -2.1041 H 1 UNL1111111111 0.1684 68 H 7.1740 -1.7535 2.8701 H 1 UNL1111111111 0.1804 69 H 6.1661 -2.6018 -2.8338 H 1 UNL1111111111 0.1686 70 H 7.4728 -3.9271 -1.1447 H 1 UNL1111111111 0.1708 @BOND 1 1 10 1 2 2 10 1 3 3 29 1 4 3 64 1 5 4 30 1 6 4 31 1 7 5 13 1 8 5 18 1 9 5 19 1 10 6 22 1 11 6 23 1 12 6 28 1 13 7 34 ar 14 7 39 ar 15 8 9 1 16 8 10 1 17 8 11 1 18 8 40 1 19 9 10 1 20 9 12 1 21 9 41 1 22 11 14 ar 23 11 16 ar 24 12 15 ar 25 12 17 ar 26 13 14 1 27 13 15 1 28 13 42 1 29 14 20 ar 30 15 21 ar 31 16 24 ar 32 16 43 1 33 17 25 ar 34 17 44 1 35 18 22 1 36 18 45 1 37 18 46 1 38 19 23 1 39 19 47 1 40 19 48 1 41 20 26 ar 42 20 49 1 43 21 27 ar 44 21 50 1 45 22 51 1 46 22 52 1 47 23 53 1 48 23 54 1 49 24 26 ar 50 24 55 1 51 25 27 ar 52 25 56 1 53 26 57 1 54 27 58 1 55 28 29 1 56 28 59 1 57 28 60 1 58 29 30 1 59 29 61 1 60 30 62 1 61 30 63 1 62 31 32 ar 63 31 33 ar 64 32 34 ar 65 32 36 ar 66 33 35 ar 67 33 65 1 68 34 37 ar 69 35 37 ar 70 35 66 1 71 36 38 ar 72 36 67 1 73 37 68 1 74 38 39 ar 75 38 69 1 76 39 70 1