L57LUM -OEChem-05032301143D 82 87 0 1 0 0 0 0 0999 V2000 6.6151 0.5065 0.6603 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1440 3.0789 -1.5157 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5770 1.3924 2.3727 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.7761 1.2331 1.4000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5375 1.0609 0.0554 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7886 1.4319 0.0466 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.7225 0.2179 0.9294 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2587 1.5350 -0.2969 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2343 2.7522 -0.2863 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7468 1.2802 -1.7585 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1925 2.7501 -1.8232 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7941 1.9326 -0.1103 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8942 0.7187 -0.3841 C 0 0 1 0 0 0 0 0 0 0 0 0 4.4418 -0.5283 0.2798 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7623 -0.5686 0.7525 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6696 -1.6969 0.3812 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8805 1.9305 -0.9108 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2775 -1.7145 1.3637 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4466 2.2706 -0.4989 C 0 0 2 0 0 0 0 0 0 0 0 0 4.1858 -2.8479 0.9818 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4862 -2.8541 1.4791 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4323 1.0373 -0.3233 C 0 0 2 0 0 0 0 0 0 0 0 0 3.3423 -4.0737 1.0881 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4566 0.1830 -1.6090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5344 -4.1120 2.3827 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4184 -0.9824 -1.5179 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2523 1.4346 1.3510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6887 -0.8961 -2.1129 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0922 -2.1252 -0.7813 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6433 -1.9120 -1.9451 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7325 1.4284 1.4024 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0090 -1.7946 -2.5757 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8436 -0.5784 -2.1378 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0213 -3.1561 -0.6361 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2894 -3.0501 -1.2115 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8669 -0.8580 -1.0273 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3118 -1.0155 0.3916 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3452 0.3201 0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5021 2.5364 1.8923 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5462 1.2565 1.3884 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8401 2.4764 1.8967 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2239 2.5216 0.1261 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8672 3.6676 0.1868 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9867 0.9988 -2.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5765 0.5664 -1.8278 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4368 3.4219 -2.2454 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1468 2.9340 -2.3232 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5402 2.7657 -0.7752 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6587 2.2968 0.9181 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8987 0.4963 -1.4599 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5511 1.4963 0.9766 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6539 -1.7073 -0.0093 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4160 2.8825 -1.0071 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8932 1.4952 -1.9173 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2963 -1.7273 1.7413 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4489 2.8603 0.4264 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8969 -3.7422 1.9519 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0433 0.4253 0.5005 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6594 -4.1341 0.2314 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9734 -4.9692 1.0264 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5355 -0.2300 -1.8257 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7283 0.7941 -2.4792 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4422 1.6144 -0.7101 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 3.8812 -1.6051 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1903 -4.0973 3.2597 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9305 -5.0239 2.4242 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8586 -3.2528 2.4526 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9481 -0.0100 -2.6892 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1190 -2.2140 -0.3053 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8439 -1.7281 -3.6599 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5822 -2.7175 -2.4243 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2204 0.2839 -1.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4291 -0.2702 -3.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7609 -4.0410 -0.0621 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5940 -0.0360 -1.0307 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4327 -1.7623 -1.2836 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0000 -3.8614 -1.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1446 -1.2867 1.0527 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5913 -1.8386 0.4446 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7901 -0.5415 0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9856 3.4174 2.2565 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4447 3.2988 2.2608 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 15 1 0 0 0 0 2 19 1 0 0 0 0 2 64 1 0 0 0 0 3 27 2 0 0 0 0 4 40 2 0 0 0 0 5 13 1 0 0 0 0 5 17 1 0 0 0 0 5 51 1 0 0 0 0 6 22 1 0 0 0 0 6 27 1 0 0 0 0 6 63 1 0 0 0 0 7 37 1 0 0 0 0 7 38 1 0 0 0 0 7 40 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 1 0 0 0 0 9 11 1 0 0 0 0 9 42 1 0 0 0 0 9 43 1 0 0 0 0 10 11 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 11 46 1 0 0 0 0 11 47 1 0 0 0 0 12 13 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 50 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 15 18 1 0 0 0 0 16 20 2 0 0 0 0 16 52 1 0 0 0 0 17 19 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 21 2 0 0 0 0 18 55 1 0 0 0 0 19 22 1 0 0 0 0 19 56 1 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 21 57 1 0 0 0 0 22 24 1 0 0 0 0 22 58 1 0 0 0 0 23 25 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 24 26 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 65 1 0 0 0 0 25 66 1 0 0 0 0 25 67 1 0 0 0 0 26 28 1 0 0 0 0 26 29 2 0 0 0 0 27 31 1 0 0 0 0 28 30 2 0 0 0 0 28 68 1 0 0 0 0 29 34 1 0 0 0 0 29 69 1 0 0 0 0 30 32 1 0 0 0 0 30 35 1 0 0 0 0 31 38 2 0 0 0 0 31 39 1 0 0 0 0 32 33 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 33 36 1 0 0 0 0 33 72 1 0 0 0 0 33 73 1 0 0 0 0 34 35 2 0 0 0 0 34 74 1 0 0 0 0 35 77 1 0 0 0 0 36 37 1 0 0 0 0 36 75 1 0 0 0 0 36 76 1 0 0 0 0 37 78 1 0 0 0 0 37 79 1 0 0 0 0 38 80 1 0 0 0 0 39 41 2 0 0 0 0 39 81 1 0 0 0 0 40 41 1 0 0 0 0 41 82 1 0 0 0 0 M END $$$$