@MOLECULE pramiconazole 87 93 0 0 0 SMALL GASTEIGER @ATOM 1 F -6.9352 -0.4690 1.7251 F 1 UNL11 -0.1616 2 F -8.5694 0.8628 -2.4287 F 1 UNL11 -0.1576 3 O -3.4978 -1.9346 -0.2390 O.3 1 UNL11 -0.4512 4 O -4.4043 -3.8658 0.6054 O.3 1 UNL11 -0.4217 5 O -0.9305 -3.1414 -0.1899 O.3 1 UNL11 -0.3372 6 O 8.1698 0.7821 0.5971 O.2 1 UNL11 -0.5203 7 N 2.3337 3.5599 -0.2373 N.pl3 1 UNL11 -0.4106 8 N -0.0582 2.2741 0.7146 N.pl3 1 UNL11 -0.4081 9 N 8.5095 -1.1806 -0.5940 N.am 1 UNL11 -0.5101 10 N 6.3649 -0.3902 -0.3166 N.am 1 UNL11 -0.4838 11 N -3.7772 0.8308 0.9613 N.ar 1 UNL11 -0.1448 12 N -4.1577 1.9430 1.6470 N.ar 1 UNL11 -0.2785 13 N -3.4858 2.5196 -0.4448 N.ar 1 UNL11 -0.4296 14 C -4.5370 -1.5123 0.6449 C.3 1 UNL11 0.2271 15 C -4.9615 -2.8095 1.3761 C.3 1 UNL11 -0.0687 16 C -3.8625 -0.4789 1.5854 C.3 1 UNL11 -0.1169 17 C -3.3401 -3.3415 -0.1641 C.3 1 UNL11 0.2997 18 C -5.6430 -0.9207 -0.1779 C.ar 1 UNL11 -0.1847 19 C 1.8982 3.7962 1.1543 C.3 1 UNL11 -0.1197 20 C 1.1749 3.4372 -1.1503 C.3 1 UNL11 -0.1403 21 C 0.9686 2.6810 1.7010 C.3 1 UNL11 -0.1317 22 C -0.1648 3.2187 -0.4037 C.3 1 UNL11 -0.1291 23 C 7.6436 -2.2416 -1.1485 C.3 1 UNL11 -0.1083 24 C 6.2098 -1.6395 -1.0959 C.3 1 UNL11 -0.0959 25 C -2.0152 -3.6862 0.5393 C.3 1 UNL11 -0.1137 26 C 3.3063 2.5034 -0.3039 C.ar 1 UNL11 0.1073 27 C 9.7602 -1.5453 0.0946 C.3 1 UNL11 0.1396 28 C -0.1629 0.8992 0.4447 C.ar 1 UNL11 0.1989 29 C 7.7255 -0.1517 -0.0285 C.2 1 UNL11 0.6953 30 C 5.3629 0.6008 -0.3603 C.ar 1 UNL11 0.2100 31 C -6.7949 -0.3897 0.4123 C.ar 1 UNL11 0.2391 32 C -5.5271 -0.8519 -1.5690 C.ar 1 UNL11 -0.0412 33 C 3.0304 1.1781 -0.6463 C.ar 1 UNL11 -0.1878 34 C 4.6286 2.8773 -0.0122 C.ar 1 UNL11 -0.1362 35 C 4.0465 0.2298 -0.6763 C.ar 1 UNL11 -0.2230 36 C 5.6476 1.9389 -0.0384 C.ar 1 UNL11 -0.2036 37 C 9.5210 -2.3685 1.3697 C.3 1 UNL11 -0.4974 38 C 10.6675 -2.3032 -0.8832 C.3 1 UNL11 -0.4686 39 C -0.4358 0.3977 -0.8439 C.ar 1 UNL11 -0.2652 40 C -0.1215 -0.0010 1.5331 C.ar 1 UNL11 -0.2296 41 C -0.7052 -1.8042 0.0648 C.ar 1 UNL11 0.1446 42 C -7.8098 0.2238 -0.3170 C.ar 1 UNL11 -0.2939 43 C -6.5168 -0.2524 -2.3426 C.ar 1 UNL11 -0.2550 44 C -3.3694 1.1838 -0.3200 C.ar 1 UNL11 0.0976 45 C -0.7194 -0.9491 -1.0344 C.ar 1 UNL11 -0.1421 46 C -0.3835 -1.3488 1.3435 C.ar 1 UNL11 -0.1828 47 C -7.6332 0.2808 -1.6985 C.ar 1 UNL11 0.2518 48 C -3.9683 2.9682 0.7801 C.ar 1 UNL11 0.0750 49 H -6.0470 -3.0035 1.3675 H 1 UNL11 0.1653 50 H -4.5700 -2.8858 2.4029 H 1 UNL11 0.1399 51 H -2.8205 -0.8264 1.8235 H 1 UNL11 0.1865 52 H -4.4094 -0.3972 2.5565 H 1 UNL11 0.1896 53 H -3.4403 -3.7384 -1.1917 H 1 UNL11 0.1481 54 H 1.3859 4.7832 1.1818 H 1 UNL11 0.1500 55 H 2.7939 3.8894 1.8061 H 1 UNL11 0.1511 56 H 1.3382 2.6462 -1.9085 H 1 UNL11 0.1426 57 H 1.1282 4.3993 -1.7133 H 1 UNL11 0.1515 58 H 0.4287 3.0450 2.6037 H 1 UNL11 0.1480 59 H 1.5932 1.8149 2.0132 H 1 UNL11 0.1498 60 H -0.9713 2.9038 -1.1039 H 1 UNL11 0.1701 61 H -0.5300 4.1838 0.0226 H 1 UNL11 0.1573 62 H 7.9647 -2.4504 -2.1897 H 1 UNL11 0.1528 63 H 7.7083 -3.1873 -0.5768 H 1 UNL11 0.1392 64 H 5.5011 -2.3145 -0.5722 H 1 UNL11 0.1539 65 H 5.8162 -1.4396 -2.1136 H 1 UNL11 0.1509 66 H -1.8219 -4.7753 0.4953 H 1 UNL11 0.1541 67 H -2.0141 -3.3661 1.5930 H 1 UNL11 0.1401 68 H 10.2520 -0.5671 0.3761 H 1 UNL11 0.1663 69 H -4.6413 -1.2707 -2.0594 H 1 UNL11 0.1810 70 H 2.0123 0.8658 -0.8788 H 1 UNL11 0.1677 71 H 4.8490 3.9178 0.2304 H 1 UNL11 0.1682 72 H 3.7966 -0.7982 -0.9248 H 1 UNL11 0.1606 73 H 6.6686 2.2506 0.1982 H 1 UNL11 0.1967 74 H 9.0874 -3.3494 1.1577 H 1 UNL11 0.1460 75 H 8.8427 -1.8442 2.0563 H 1 UNL11 0.1641 76 H 10.4615 -2.5329 1.9072 H 1 UNL11 0.1563 77 H 10.2739 -3.2931 -1.1326 H 1 UNL11 0.1450 78 H 10.7813 -1.7452 -1.8225 H 1 UNL11 0.1622 79 H 11.6669 -2.4403 -0.4560 H 1 UNL11 0.1521 80 H -0.4347 1.0607 -1.7064 H 1 UNL11 0.1678 81 H 0.0965 0.3662 2.5337 H 1 UNL11 0.1654 82 H -8.6898 0.6452 0.1690 H 1 UNL11 0.2003 83 H -6.4118 -0.1936 -3.4255 H 1 UNL11 0.1852 84 H -3.0137 0.4844 -1.0607 H 1 UNL11 0.2124 85 H -0.9475 -1.3401 -2.0241 H 1 UNL11 0.1678 86 H -0.3306 -2.0429 2.1789 H 1 UNL11 0.1593 87 H -4.1604 4.0041 0.9983 H 1 UNL11 0.1992 @BOND 1 1 31 1 2 2 47 1 3 3 14 1 4 3 17 1 5 4 15 1 6 4 17 1 7 5 25 1 8 5 41 1 9 6 29 2 10 7 19 1 11 7 20 1 12 7 26 1 13 8 21 1 14 8 22 1 15 8 28 1 16 9 23 1 17 9 27 1 18 9 29 am 19 10 24 1 20 10 29 am 21 10 30 1 22 11 12 ar 23 11 16 1 24 11 44 ar 25 12 48 ar 26 13 44 ar 27 13 48 ar 28 14 15 1 29 14 16 1 30 14 18 1 31 15 49 1 32 15 50 1 33 16 51 1 34 16 52 1 35 17 25 1 36 17 53 1 37 18 31 ar 38 18 32 ar 39 19 21 1 40 19 54 1 41 19 55 1 42 20 22 1 43 20 56 1 44 20 57 1 45 21 58 1 46 21 59 1 47 22 60 1 48 22 61 1 49 23 24 1 50 23 62 1 51 23 63 1 52 24 64 1 53 24 65 1 54 25 66 1 55 25 67 1 56 26 33 ar 57 26 34 ar 58 27 37 1 59 27 38 1 60 27 68 1 61 28 39 ar 62 28 40 ar 63 30 35 ar 64 30 36 ar 65 31 42 ar 66 32 43 ar 67 32 69 1 68 33 35 ar 69 33 70 1 70 34 36 ar 71 34 71 1 72 35 72 1 73 36 73 1 74 37 74 1 75 37 75 1 76 37 76 1 77 38 77 1 78 38 78 1 79 38 79 1 80 39 45 ar 81 39 80 1 82 40 46 ar 83 40 81 1 84 41 45 ar 85 41 46 ar 86 42 47 ar 87 42 82 1 88 43 47 ar 89 43 83 1 90 44 84 1 91 45 85 1 92 46 86 1 93 48 87 1