L78GKU -OEChem-05032301143D 87 92 0 0 0 0 0 0 0999 V2000 -0.0838 6.5025 -2.7961 F 0 0 0 0 0 0 0 0 0 0 0 0 1.6279 5.6405 -1.7367 F 0 0 0 0 0 0 0 0 0 0 0 0 1.0596 7.7257 -1.3845 F 0 0 0 0 0 0 0 0 0 0 0 0 8.0874 -4.5215 0.4097 F 0 0 0 0 0 0 0 0 0 0 0 0 6.1287 -2.9943 1.2912 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2863 7.0937 -0.2315 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1291 3.2603 2.4436 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.3016 -4.1533 -0.8000 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5941 1.7269 0.6817 N 0 0 0 0 0 0 0 0 0 0 0 0 5.2153 -2.5417 -0.7034 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0175 -2.1810 1.5471 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1674 0.3616 -0.3197 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3265 -1.1259 0.0968 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8367 -0.8426 0.5841 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2802 1.1886 0.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7149 -0.1781 -1.6526 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0814 -1.7095 0.8208 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 0.3327 0.5930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9638 -1.0371 -1.4153 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0776 1.2197 -0.5528 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5319 -1.9564 0.3225 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1942 4.0693 0.2177 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1729 2.9847 1.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3284 6.0492 -0.5059 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4052 5.5067 0.7491 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9387 4.6321 -0.6726 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5890 0.9347 1.4083 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1731 -3.1574 -0.0571 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5932 6.4912 -1.6359 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4660 0.1057 0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6607 1.0108 2.7992 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2676 -3.9856 -0.5809 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4148 -0.6474 1.4008 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6093 0.2578 3.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2451 -3.1941 -1.4850 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7660 -5.2265 -1.3608 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4865 -0.5713 2.7916 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3260 -1.5067 0.6767 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9297 -2.0848 -0.5294 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6006 -1.7574 1.1846 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8082 -2.9134 -1.2276 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4791 -2.5860 0.4865 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0829 -3.1640 -0.7196 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0222 -4.0499 -1.4658 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4968 -5.5013 -1.5792 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3313 -3.5072 -2.8814 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -1.4592 0.1433 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4941 -0.5284 1.5733 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9672 1.5796 1.3271 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5548 2.0500 -0.2658 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9644 0.6486 -2.3299 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9532 -0.7777 -2.1671 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8847 -2.7327 0.4737 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2649 -1.7904 1.9005 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7766 0.3444 1.6635 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3911 0.7906 0.0848 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7917 -2.0401 -1.8285 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8015 -0.6150 -1.9869 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1950 2.0484 -1.2123 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8150 0.6662 -1.1353 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0759 3.7779 -0.3672 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4513 5.8090 0.8615 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1135 5.7327 1.6886 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9622 4.2404 -1.6941 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9420 4.5248 -0.2426 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4798 0.1021 -0.3737 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9672 1.5629 3.4176 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8445 6.7577 0.4902 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6490 0.2971 4.5758 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6842 -2.3590 -0.9277 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7368 -2.7883 -2.3661 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0726 -3.8314 -1.8147 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1737 -4.9380 -2.2356 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1403 -5.8523 -0.7145 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6077 -5.8449 -1.6905 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1847 -1.1649 3.3754 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9361 -1.9456 -0.9471 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9636 -1.3054 2.1036 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4745 -3.3604 -2.1599 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4644 -2.7525 0.9115 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2298 -6.1478 -2.0757 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5574 -5.5584 -2.1386 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3276 -5.9277 -0.5832 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0799 -4.1294 -3.3858 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4402 -3.4678 -3.5162 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7542 -2.4971 -2.8225 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.8733 -4.7370 -1.3275 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 2 29 1 0 0 0 0 3 29 1 0 0 0 0 4 32 1 0 0 0 0 5 11 1 0 0 0 0 5 28 1 0 0 0 0 6 24 1 0 0 0 0 6 68 1 0 0 0 0 7 23 2 0 0 0 0 8 44 1 0 0 0 0 8 87 1 0 0 0 0 9 20 1 0 0 0 0 9 23 1 0 0 0 0 9 27 1 0 0 0 0 10 21 1 0 0 0 0 10 28 2 0 0 0 0 11 21 2 0 0 0 0 12 14 1 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 20 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 21 1 0 0 0 0 14 17 1 0 0 0 0 14 47 1 0 0 0 0 14 48 1 0 0 0 0 15 18 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 19 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 53 1 0 0 0 0 17 54 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 57 1 0 0 0 0 19 58 1 0 0 0 0 20 59 1 0 0 0 0 20 60 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 26 1 0 0 0 0 22 61 1 0 0 0 0 24 25 1 0 0 0 0 24 26 1 0 0 0 0 24 29 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 64 1 0 0 0 0 26 65 1 0 0 0 0 27 30 1 0 0 0 0 27 31 2 0 0 0 0 28 32 1 0 0 0 0 30 33 2 0 0 0 0 30 66 1 0 0 0 0 31 34 1 0 0 0 0 31 67 1 0 0 0 0 32 35 1 0 0 0 0 32 36 1 0 0 0 0 33 37 1 0 0 0 0 33 38 1 0 0 0 0 34 37 2 0 0 0 0 34 69 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 36 73 1 0 0 0 0 36 74 1 0 0 0 0 36 75 1 0 0 0 0 37 76 1 0 0 0 0 38 39 2 0 0 0 0 38 40 1 0 0 0 0 39 41 1 0 0 0 0 39 77 1 0 0 0 0 40 42 2 0 0 0 0 40 78 1 0 0 0 0 41 43 2 0 0 0 0 41 79 1 0 0 0 0 42 43 1 0 0 0 0 42 80 1 0 0 0 0 43 44 1 0 0 0 0 44 45 1 0 0 0 0 44 46 1 0 0 0 0 45 81 1 0 0 0 0 45 82 1 0 0 0 0 45 83 1 0 0 0 0 46 84 1 0 0 0 0 46 85 1 0 0 0 0 46 86 1 0 0 0 0 M END $$$$