B5EZG9 -OEChem-04022106352D 41 43 0 0 0 0 0 0 0999 V2000 8.6279 -0.1340 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.7320 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2679 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 1.5368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2679 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5443 -0.0727 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.2320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.2320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1279 0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 0.7321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2321 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8550 2.4873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6279 -0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6279 -1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1279 -2.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6279 -1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1279 -2.7320 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7105 0.9441 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0202 1.3426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4443 2.2947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0476 3.0766 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2656 2.6799 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0453 -0.3460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7356 -0.7446 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1120 -1.2680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3520 -1.2680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 2.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 2.0420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.1951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0079 -1.8660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4379 -0.4631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8179 -3.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2479 -1.8660 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4379 -3.2690 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 18 1 0 0 0 0 2 12 2 0 0 0 0 3 13 2 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 14 1 0 0 0 0 5 9 1 0 0 0 0 5 13 1 0 0 0 0 5 16 1 0 0 0 0 6 9 1 0 0 0 0 6 10 2 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 7 17 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 10 11 1 0 0 0 0 11 15 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 14 26 1 0 0 0 0 14 27 1 0 0 0 0 14 28 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 37 1 0 0 0 0 20 22 2 0 0 0 0 20 38 1 0 0 0 0 21 23 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 M END $$$$