DI4HA7 -OEChem-06062108572D 82 85 0 1 0 0 0 0 0999 V2000 7.2962 0.3295 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.9891 -2.8540 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6999 -4.0107 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3357 2.1499 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.5819 3.7191 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 6.0536 -5.0821 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8495 5.0821 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3392 -0.0830 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6964 -1.7778 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6249 3.3067 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9856 -0.6210 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.5604 3.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0536 -3.4726 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1074 -3.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1074 -4.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2712 2.7686 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8710 4.8758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6372 -4.2773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3642 -2.5221 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2927 2.5624 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6499 0.8676 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9390 2.0243 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6284 1.0738 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2413 -3.2773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9820 1.6119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2413 -5.2773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9140 4.4634 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3428 -2.3159 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3642 -6.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0071 -0.8273 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3753 -3.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3753 -4.7773 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1602 6.0326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5174 4.3378 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6534 -1.3654 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0106 -3.0602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6464 3.1005 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6569 -3.5982 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2747 0.5357 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6354 -3.3920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3463 -4.5488 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9785 3.8448 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 3.6385 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5809 3.3057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1742 3.8380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8505 5.4955 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2572 4.9632 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2572 -4.2773 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5457 2.1521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2413 -2.6573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3754 1.4840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3755 4.8775 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 4.9249 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4526 4.0493 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2413 -5.8973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7749 -6.2252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5568 -6.6219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9536 -5.8400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7325 -0.2108 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8384 -3.4673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8384 -5.0873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8175 3.8960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7495 5.8400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3528 6.6219 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5709 6.2252 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0559 3.9237 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9314 3.8763 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9788 4.7518 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2601 -1.2375 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8496 -3.0089 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4026 -0.0710 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8814 0.6635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1469 1.1424 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7633 -3.9987 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2421 -3.2642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5076 -2.7854 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7570 -4.3562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1537 -5.1381 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9356 -4.7414 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1711 4.4341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5859 4.1000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8074 3.0492 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 23 1 0 0 0 0 1 39 1 0 0 0 0 2 36 1 0 0 0 0 2 38 1 0 0 0 0 3 36 2 0 0 0 0 4 37 2 0 0 0 0 5 12 1 0 0 0 0 5 16 1 0 0 0 0 5 27 1 0 0 0 0 6 15 1 0 0 0 0 6 18 1 0 0 0 0 6 29 1 0 0 0 0 7 17 1 0 0 0 0 7 33 1 0 0 0 0 7 34 1 0 0 0 0 8 21 1 0 0 0 0 8 30 1 0 0 0 0 8 59 1 0 0 0 0 9 19 2 0 0 0 0 9 30 1 0 0 0 0 10 20 1 0 0 0 0 10 37 1 0 0 0 0 10 62 1 0 0 0 0 11 30 2 0 0 0 0 11 35 1 0 0 0 0 12 17 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 14 1 0 0 0 0 13 18 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 24 2 0 0 0 0 15 26 2 0 0 0 0 16 20 1 0 0 0 0 16 22 2 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 48 1 0 0 0 0 19 28 1 0 0 0 0 20 25 2 0 0 0 0 21 23 2 0 0 0 0 21 25 1 0 0 0 0 22 23 1 0 0 0 0 22 49 1 0 0 0 0 24 31 1 0 0 0 0 24 50 1 0 0 0 0 25 51 1 0 0 0 0 26 32 1 0 0 0 0 26 55 1 0 0 0 0 27 52 1 0 0 0 0 27 53 1 0 0 0 0 27 54 1 0 0 0 0 28 35 2 0 0 0 0 28 36 1 0 0 0 0 29 56 1 0 0 0 0 29 57 1 0 0 0 0 29 58 1 0 0 0 0 31 32 2 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 33 63 1 0 0 0 0 33 64 1 0 0 0 0 33 65 1 0 0 0 0 34 66 1 0 0 0 0 34 67 1 0 0 0 0 34 68 1 0 0 0 0 35 69 1 0 0 0 0 37 42 1 0 0 0 0 38 40 1 0 0 0 0 38 41 1 0 0 0 0 38 70 1 0 0 0 0 39 71 1 0 0 0 0 39 72 1 0 0 0 0 39 73 1 0 0 0 0 40 74 1 0 0 0 0 40 75 1 0 0 0 0 40 76 1 0 0 0 0 41 77 1 0 0 0 0 41 78 1 0 0 0 0 41 79 1 0 0 0 0 42 43 2 0 0 0 0 42 80 1 0 0 0 0 43 81 1 0 0 0 0 43 82 1 0 0 0 0 M END $$$$