D0N4QQ -OEChem-10101305022D 83 86 0 1 0 0 0 0 0999 V2000 7.2755 -2.5067 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.0076 -2.5001 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6038 0.0424 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4609 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 13.0925 3.0529 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.1251 0.5914 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 8.2151 0.0846 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.9911 0.0914 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 10.8572 0.5914 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.2071 -0.9570 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.8572 1.5914 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 9.1251 1.5914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0072 -0.9501 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1092 -1.4779 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9911 2.0914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2883 0.6486 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2717 -1.5068 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.8034 0.2867 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.8034 1.8961 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2228 1.0845 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3320 -0.9643 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.3404 0.1207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8572 2.5914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3870 1.0914 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1140 2.8467 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 11.4462 3.5910 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1435 -3.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6000 -0.9576 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.4032 4.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7604 2.3086 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1473 -4.0034 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.4542 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 -0.9509 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4476 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 0.0491 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8612 1.0164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7305 -0.3279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9471 -0.2538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2104 -1.8070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9131 2.1740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5145 1.4837 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2252 -1.5305 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6163 -0.8346 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7118 -1.9538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5101 -1.9507 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3897 2.5664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5926 2.5664 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6965 1.1153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8984 1.1307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7353 -1.8178 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5523 -0.2802 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3408 -0.0225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8428 1.0798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2276 1.7045 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6028 1.0893 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7969 -0.6512 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1358 0.7060 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7287 0.0193 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4772 2.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8572 3.2114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2372 2.5914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0070 1.0914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3067 3.4360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4617 -2.0809 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9077 4.0050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0321 4.0524 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9847 3.1769 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.9925 3.8108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.5958 4.5927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8139 4.1960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2989 1.8945 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1745 1.8471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.2219 2.7226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5273 -4.0058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1497 -4.6234 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7673 -4.0010 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7296 -2.0742 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 -0.9094 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 -1.7555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 -1.9857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4918 0.0467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8742 0.6691 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2518 0.0515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 17 1 1 1 0 0 0 1 27 1 0 0 0 0 2 27 2 0 0 0 0 3 28 2 0 0 0 0 21 4 1 1 0 0 0 4 28 1 0 0 0 0 4 64 1 0 0 0 0 25 5 1 6 0 0 0 5 29 1 0 0 0 0 5 30 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 12 1 0 0 0 0 6 36 1 6 0 0 0 7 10 1 0 0 0 0 7 16 1 0 0 0 0 7 20 1 1 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 37 1 1 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 9 38 1 6 0 0 0 10 14 1 0 0 0 0 10 17 1 0 0 0 0 10 39 1 6 0 0 0 11 15 1 0 0 0 0 11 19 1 0 0 0 0 11 23 1 1 0 0 0 12 15 1 0 0 0 0 12 40 1 0 0 0 0 12 41 1 0 0 0 0 13 14 1 0 0 0 0 13 42 1 0 0 0 0 13 43 1 0 0 0 0 14 44 1 0 0 0 0 14 45 1 0 0 0 0 15 46 1 0 0 0 0 15 47 1 0 0 0 0 16 22 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 17 21 1 0 0 0 0 17 50 1 0 0 0 0 18 24 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 19 24 2 0 0 0 0 19 25 1 0 0 0 0 20 53 1 0 0 0 0 20 54 1 0 0 0 0 20 55 1 0 0 0 0 21 22 1 0 0 0 0 21 56 1 0 0 0 0 22 57 1 0 0 0 0 22 58 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 23 61 1 0 0 0 0 24 62 1 0 0 0 0 25 26 1 0 0 0 0 25 63 1 0 0 0 0 26 65 1 0 0 0 0 26 66 1 0 0 0 0 26 67 1 0 0 0 0 27 31 1 0 0 0 0 28 32 1 0 0 0 0 29 68 1 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 30 71 1 0 0 0 0 30 72 1 0 0 0 0 30 73 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 31 76 1 0 0 0 0 32 33 2 0 0 0 0 32 77 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 34 80 1 0 0 0 0 35 81 1 0 0 0 0 35 82 1 0 0 0 0 35 83 1 0 0 0 0 M END $$$$