LE4B0Q -OEChem-05032301023D 70 75 0 0 0 0 0 0 0999 V2000 -3.0648 -0.7920 -1.1687 S 0 0 0 0 0 0 0 0 0 0 0 0 7.4760 1.2312 -0.4928 S 0 0 0 0 0 0 0 0 0 0 0 0 -6.3160 -1.9111 0.1845 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0271 -4.3366 -0.0778 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.0107 -5.2382 -0.5265 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5459 1.1050 -0.8364 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7977 -1.8380 -0.4991 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8315 1.4922 -0.9213 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6529 -0.4327 0.2554 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3916 4.1842 1.7250 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0488 4.4981 -0.5197 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4950 4.4678 -0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4452 3.1181 -0.5631 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2991 3.4924 -0.8865 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2332 1.9605 -0.7069 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7155 2.0963 -0.8001 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6139 0.7049 -0.7694 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9521 2.9949 -0.5041 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7765 0.6000 -0.6958 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5592 1.7424 -0.5650 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4034 -0.6985 -0.7498 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9842 -2.4975 -1.0074 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1865 -3.3213 -1.2482 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8501 -3.8005 0.0552 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7057 -2.8681 -0.6470 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3471 -2.6484 0.9171 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8533 0.7053 -0.3672 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2914 -4.2259 -0.4263 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4020 -0.5689 0.4497 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9881 -0.1779 0.3589 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8681 -0.9516 0.6778 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8023 0.3155 -0.5519 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0881 -0.0877 1.7207 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5751 2.1626 0.9887 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8888 1.6813 -0.2824 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1746 1.2782 1.9902 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2875 -0.5703 0.7190 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0579 -2.1605 1.3820 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6673 3.6227 1.2773 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4475 -1.7708 1.4154 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3486 -2.5572 1.7436 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9906 4.9361 -1.5236 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4725 5.1398 0.1576 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9266 5.4728 -0.1167 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5338 4.1692 1.0089 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3085 3.5910 -0.4787 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3198 3.7996 -1.9388 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2245 -0.1887 -0.8811 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5755 3.8803 -0.4024 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6413 1.7288 -0.4787 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9196 -4.1974 -1.8518 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9220 -2.7773 -1.8546 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1606 -4.4146 0.6439 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7007 -4.4374 -0.2178 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1015 2.2283 -1.5681 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8292 -3.0576 1.8129 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4925 -2.0419 1.2381 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0465 -0.0542 -1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8038 -0.7451 2.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2014 2.3577 -1.0734 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9391 1.6366 2.9889 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1500 0.0386 0.4662 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2065 -2.7824 1.6435 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2865 -5.2715 0.0674 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0024 4.1790 0.3942 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4237 3.7839 2.0544 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4447 -2.0929 1.7037 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4924 -3.4879 2.2855 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5120 5.1784 1.9153 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7095 4.1228 0.9695 H 0 0 0 0 0 0 0 0 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 2 27 1 0 0 0 0 2 30 1 0 0 0 0 3 26 1 0 0 0 0 3 29 1 0 0 0 0 4 28 1 0 0 0 0 4 64 1 0 0 0 0 5 28 2 0 0 0 0 6 8 1 0 0 0 0 6 16 2 0 0 0 0 7 21 2 0 0 0 0 7 25 1 0 0 0 0 8 27 1 0 0 0 0 8 55 1 0 0 0 0 9 27 2 0 0 0 0 9 31 1 0 0 0 0 10 39 1 0 0 0 0 10 69 1 0 0 0 0 10 70 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 42 1 0 0 0 0 11 43 1 0 0 0 0 12 14 1 0 0 0 0 12 44 1 0 0 0 0 12 45 1 0 0 0 0 13 15 2 0 0 0 0 13 18 1 0 0 0 0 14 16 1 0 0 0 0 14 46 1 0 0 0 0 14 47 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 19 2 0 0 0 0 17 48 1 0 0 0 0 18 20 2 0 0 0 0 18 49 1 0 0 0 0 19 20 1 0 0 0 0 19 21 1 0 0 0 0 20 50 1 0 0 0 0 22 23 1 0 0 0 0 22 25 2 0 0 0 0 23 24 1 0 0 0 0 23 51 1 0 0 0 0 23 52 1 0 0 0 0 24 26 1 0 0 0 0 24 53 1 0 0 0 0 24 54 1 0 0 0 0 25 28 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 29 32 2 0 0 0 0 29 33 1 0 0 0 0 30 31 1 0 0 0 0 30 37 2 0 0 0 0 31 38 2 0 0 0 0 32 35 1 0 0 0 0 32 58 1 0 0 0 0 33 36 2 0 0 0 0 33 59 1 0 0 0 0 34 35 2 0 0 0 0 34 36 1 0 0 0 0 34 39 1 0 0 0 0 35 60 1 0 0 0 0 36 61 1 0 0 0 0 37 40 1 0 0 0 0 37 62 1 0 0 0 0 38 41 1 0 0 0 0 38 63 1 0 0 0 0 39 65 1 0 0 0 0 39 66 1 0 0 0 0 40 41 2 0 0 0 0 40 67 1 0 0 0 0 41 68 1 0 0 0 0 M END $$$$