D0H2DQ -OEChem-10121501232D 83 84 0 0 0 0 0 0 0999 V2000 6.3301 -1.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0000 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.0000 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -3.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -5.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0622 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -4.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3660 0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3660 1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 -0.5000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2942 -0.1340 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2942 -1.8660 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3301 0.0000 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 -2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.8100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9781 4.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2181 4.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5981 4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 5.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6822 -4.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0622 -3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0622 -3.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4422 -4.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0622 -4.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4422 -5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -5.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6822 -5.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9030 2.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 2.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8291 1.5560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8291 -0.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6760 -0.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9030 0.4440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 -0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7573 -2.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6042 -2.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8312 -1.5560 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8312 0.1760 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9842 0.4030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7573 -0.4440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9703 -1.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1972 -0.1900 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3503 0.0369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 -0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9501 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3301 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3301 0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7101 0.0000 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3301 -0.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 -3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 19 1 0 0 0 0 1 21 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 13 1 0 0 0 0 3 82 1 0 0 0 0 4 14 1 0 0 0 0 4 83 1 0 0 0 0 5 9 1 0 0 0 0 5 22 1 0 0 0 0 5 23 1 0 0 0 0 5 24 1 0 0 0 0 6 10 1 0 0 0 0 6 25 1 0 0 0 0 6 26 1 0 0 0 0 6 27 1 0 0 0 0 7 11 1 0 0 0 0 7 28 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 12 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 8 33 1 0 0 0 0 9 14 2 0 0 0 0 9 16 1 0 0 0 0 10 13 2 0 0 0 0 10 15 1 0 0 0 0 11 14 1 0 0 0 0 11 18 2 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 15 19 2 0 0 0 0 15 36 1 0 0 0 0 16 20 2 0 0 0 0 16 37 1 0 0 0 0 17 19 1 0 0 0 0 17 38 1 0 0 0 0 18 20 1 0 0 0 0 18 39 1 0 0 0 0 21 34 1 0 0 0 0 21 35 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 22 48 1 0 0 0 0 23 43 1 0 0 0 0 23 44 1 0 0 0 0 23 45 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 24 42 1 0 0 0 0 25 55 1 0 0 0 0 25 56 1 0 0 0 0 25 57 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 26 54 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 64 1 0 0 0 0 28 65 1 0 0 0 0 28 66 1 0 0 0 0 29 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 30 58 1 0 0 0 0 30 59 1 0 0 0 0 30 60 1 0 0 0 0 31 73 1 0 0 0 0 31 74 1 0 0 0 0 31 75 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 32 72 1 0 0 0 0 33 67 1 0 0 0 0 33 68 1 0 0 0 0 33 69 1 0 0 0 0 34 76 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 35 79 1 0 0 0 0 35 80 1 0 0 0 0 35 81 1 0 0 0 0 M END $$$$