D0I2FC -OEChem-10101305022D 75 81 0 1 0 0 0 0 0999 V2000 5.0805 3.9982 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0291 0.5129 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5600 3.8919 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0273 2.9716 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7227 0.1499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8361 -3.4538 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4489 -2.7280 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9330 -4.0687 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0235 2.4636 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 4.3106 0.8902 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.3106 2.2836 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.8168 1.5869 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6732 1.6769 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.4966 2.1610 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.6608 3.0703 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5173 3.1604 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 7.0358 1.0703 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 6.1794 0.9802 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4916 2.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8799 2.5537 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3861 1.8570 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4916 1.1563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2387 1.4907 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0280 3.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7458 2.4481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3806 1.9615 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7458 0.7258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.0175 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1563 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7874 2.8750 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7711 -0.1575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0913 4.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5616 -1.1353 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6100 -1.4427 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3036 -1.8057 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0941 -2.7835 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4005 -2.4205 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1425 -3.0909 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7877 -3.1464 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2394 -3.7058 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6750 -4.7391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3275 0.9004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7041 3.6888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0593 3.2203 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2400 3.6078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8124 0.7245 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6221 0.7084 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3503 0.3843 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5022 0.3006 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4372 2.8255 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7090 3.1496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8131 1.2574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5681 2.0159 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7458 3.0681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7451 1.4599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7458 0.1058 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.3275 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.8463 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3538 2.6229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0395 3.4414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2210 3.1272 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6165 4.4096 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4207 5.2643 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5661 5.0685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1500 -1.0271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8936 -1.6151 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9783 -3.7364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3777 -2.9558 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5971 -2.5564 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6331 -3.5758 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1094 -4.3120 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8456 -3.8357 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2594 -5.1991 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1350 -5.1547 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0906 -4.2790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 16 1 0 0 0 0 2 23 1 0 0 0 0 2 31 1 0 0 0 0 3 24 1 0 0 0 0 3 32 1 0 0 0 0 4 24 2 0 0 0 0 5 31 2 0 0 0 0 6 36 1 0 0 0 0 6 39 1 0 0 0 0 7 37 1 0 0 0 0 7 40 1 0 0 0 0 8 38 1 0 0 0 0 8 41 1 0 0 0 0 9 13 1 0 0 0 0 9 16 1 0 0 0 0 9 20 1 0 0 0 0 12 10 1 6 0 0 0 10 22 1 0 0 0 0 10 49 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 15 1 0 0 0 0 11 19 1 1 0 0 0 12 13 1 0 0 0 0 13 18 1 0 0 0 0 13 42 1 6 0 0 0 14 17 1 0 0 0 0 14 23 1 1 0 0 0 14 24 1 0 0 0 0 15 16 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 16 45 1 1 0 0 0 17 18 1 0 0 0 0 17 21 1 0 0 0 0 17 46 1 1 0 0 0 18 47 1 0 0 0 0 18 48 1 0 0 0 0 19 22 1 0 0 0 0 19 25 2 0 0 0 0 20 21 1 0 0 0 0 20 50 1 0 0 0 0 20 51 1 0 0 0 0 21 26 2 0 0 0 0 22 27 2 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 25 28 1 0 0 0 0 25 54 1 0 0 0 0 26 30 1 0 0 0 0 26 55 1 0 0 0 0 27 29 1 0 0 0 0 27 56 1 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 30 61 1 0 0 0 0 31 33 1 0 0 0 0 32 62 1 0 0 0 0 32 63 1 0 0 0 0 32 64 1 0 0 0 0 33 34 2 0 0 0 0 33 35 1 0 0 0 0 34 37 1 0 0 0 0 34 65 1 0 0 0 0 35 36 2 0 0 0 0 35 66 1 0 0 0 0 36 38 1 0 0 0 0 37 38 2 0 0 0 0 39 67 1 0 0 0 0 39 68 1 0 0 0 0 39 69 1 0 0 0 0 40 70 1 0 0 0 0 40 71 1 0 0 0 0 40 72 1 0 0 0 0 41 73 1 0 0 0 0 41 74 1 0 0 0 0 41 75 1 0 0 0 0 M END $$$$