@MOLECULE viminol 56 57 0 0 0 SMALL GASTEIGER @ATOM 1 CL -1.7171 -1.4540 0.4091 Cl 1 UNL1111111111 -0.0611 2 O 0.1530 1.2461 -2.5547 O.3 1 UNL1111111111 -0.5815 3 N 2.8032 0.0102 -0.3035 N.3 1 UNL1111111111 -0.4992 4 N -1.3615 1.5104 -0.1002 N.ar 1 UNL1111111111 -0.2063 5 C 2.8195 -1.4610 -0.4746 C.3 1 UNL1111111111 0.0978 6 C 4.0900 0.6003 0.1371 C.3 1 UNL1111111111 0.0975 7 C 2.1901 0.7878 -1.3927 C.3 1 UNL1111111111 -0.1361 8 C 0.6461 0.6495 -1.3618 C.3 1 UNL1111111111 0.1554 9 C 1.5155 -2.0203 0.1531 C.3 1 UNL1111111111 -0.2803 10 C 4.3780 0.1162 1.5800 C.3 1 UNL1111111111 -0.2775 11 C 2.9726 -1.9613 -1.9220 C.3 1 UNL1111111111 -0.4933 12 C 5.2789 0.3030 -0.7946 C.3 1 UNL1111111111 -0.4993 13 C 0.0120 1.2850 -0.1776 C.ar 1 UNL1111111111 -0.0330 14 C 1.7588 -3.3572 0.8487 C.3 1 UNL1111111111 -0.4344 15 C 5.2615 1.1122 2.3275 C.3 1 UNL1111111111 -0.4385 16 C 0.5801 1.7500 1.0105 C.ar 1 UNL1111111111 -0.1906 17 C -2.3563 1.1180 -1.0883 C.3 1 UNL1111111111 -0.0954 18 C -1.6605 2.0997 1.1183 C.ar 1 UNL1111111111 -0.0988 19 C -0.4661 2.2591 1.8223 C.ar 1 UNL1111111111 -0.2323 20 C -3.4939 0.3644 -0.4524 C.ar 1 UNL1111111111 -0.0631 21 C -3.2928 -0.8195 0.2525 C.ar 1 UNL1111111111 0.0219 22 C -4.7981 0.8507 -0.5651 C.ar 1 UNL1111111111 -0.1399 23 C -4.3356 -1.5178 0.8485 C.ar 1 UNL1111111111 -0.1683 24 C -5.8595 0.1621 0.0188 C.ar 1 UNL1111111111 -0.1499 25 C -5.6304 -1.0171 0.7270 C.ar 1 UNL1111111111 -0.1260 26 H 3.6861 -1.8627 0.1167 H 1 UNL1111111111 0.1316 27 H 3.9399 1.7144 0.1744 H 1 UNL1111111111 0.1338 28 H 2.5492 0.4970 -2.4045 H 1 UNL1111111111 0.1365 29 H 2.4489 1.8636 -1.2695 H 1 UNL1111111111 0.1398 30 H 0.3318 -0.4149 -1.4919 H 1 UNL1111111111 0.1598 31 H 1.1218 -1.2803 0.8837 H 1 UNL1111111111 0.1693 32 H 0.7379 -2.1362 -0.6218 H 1 UNL1111111111 0.1365 33 H 3.4129 -0.0102 2.1155 H 1 UNL1111111111 0.1630 34 H 4.8496 -0.8815 1.5709 H 1 UNL1111111111 0.1324 35 H 3.0576 -3.0531 -1.9392 H 1 UNL1111111111 0.1478 36 H 2.1101 -1.6963 -2.5432 H 1 UNL1111111111 0.1552 37 H 3.8672 -1.5495 -2.3975 H 1 UNL1111111111 0.1427 38 H 6.1783 0.8277 -0.4571 H 1 UNL1111111111 0.1477 39 H 5.5169 -0.7645 -0.8236 H 1 UNL1111111111 0.1481 40 H 5.0694 0.6253 -1.8190 H 1 UNL1111111111 0.1452 41 H 0.8233 -3.7600 1.2552 H 1 UNL1111111111 0.1439 42 H 2.4584 -3.2532 1.6851 H 1 UNL1111111111 0.1385 43 H 2.1673 -4.1028 0.1592 H 1 UNL1111111111 0.1351 44 H 5.4731 0.7632 3.3445 H 1 UNL1111111111 0.1405 45 H 4.7774 2.0922 2.4134 H 1 UNL1111111111 0.1452 46 H 6.2230 1.2586 1.8246 H 1 UNL1111111111 0.1378 47 H 1.6176 1.7049 1.2702 H 1 UNL1111111111 0.1717 48 H -2.7226 2.0326 -1.6172 H 1 UNL1111111111 0.1567 49 H -1.8788 0.4873 -1.8879 H 1 UNL1111111111 0.1972 50 H 0.2583 2.2164 -2.5313 H 1 UNL1111111111 0.3210 51 H -2.6600 2.3565 1.3992 H 1 UNL1111111111 0.1578 52 H -0.3541 2.6828 2.7948 H 1 UNL1111111111 0.1553 53 H -4.9901 1.7748 -1.1100 H 1 UNL1111111111 0.1592 54 H -4.1511 -2.4383 1.4024 H 1 UNL1111111111 0.1724 55 H -6.8728 0.5494 -0.0757 H 1 UNL1111111111 0.1555 56 H -6.4627 -1.5482 1.1865 H 1 UNL1111111111 0.1553 @BOND 1 1 21 1 2 2 8 1 3 2 50 1 4 3 5 1 5 3 6 1 6 3 7 1 7 4 13 ar 8 4 17 1 9 4 18 ar 10 5 9 1 11 5 11 1 12 5 26 1 13 6 10 1 14 6 12 1 15 6 27 1 16 7 8 1 17 7 28 1 18 7 29 1 19 8 13 1 20 8 30 1 21 9 14 1 22 9 31 1 23 9 32 1 24 10 15 1 25 10 33 1 26 10 34 1 27 11 35 1 28 11 36 1 29 11 37 1 30 12 38 1 31 12 39 1 32 12 40 1 33 13 16 ar 34 14 41 1 35 14 42 1 36 14 43 1 37 15 44 1 38 15 45 1 39 15 46 1 40 16 19 ar 41 16 47 1 42 17 20 1 43 17 48 1 44 17 49 1 45 18 19 ar 46 18 51 1 47 19 52 1 48 20 21 ar 49 20 22 ar 50 21 23 ar 51 22 24 ar 52 22 53 1 53 23 25 ar 54 23 54 1 55 24 25 ar 56 24 55 1 57 25 56 1