D01QKR -OEChem-04152109372D 70 73 0 1 0 0 0 0 0999 V2000 10.5314 -0.0260 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5314 -3.4901 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0314 2.5721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9999 0.8182 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.5314 -1.7580 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.5314 -0.0260 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 12.5314 -1.7580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1192 -0.9490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1192 -2.5671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0702 -1.2580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.0702 -2.2580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0314 -0.8920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0314 -2.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0314 -0.8920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.0314 -2.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5314 -1.7580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0314 -0.8920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0314 -0.8920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0314 0.8400 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.5314 -0.0260 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0314 0.8400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0314 -0.8920 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5314 1.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5314 1.7060 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5314 -1.7580 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0314 2.5721 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4899 1.6900 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0314 -2.6241 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5245 3.4821 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9621 2.5880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4830 3.4901 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.8067 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.3714 -0.3826 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5822 -0.6390 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5822 -2.8771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3714 -3.1335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6868 -1.3229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1991 -0.6516 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1991 -2.8645 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6868 -2.1932 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6140 -0.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9237 -0.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9237 -3.2347 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6140 -2.8361 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9488 -1.9701 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6391 -2.3686 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6140 -0.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9237 -0.2814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4488 -1.1041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1391 -1.5026 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6514 0.8400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1140 0.1860 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4237 0.5846 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4488 0.6280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1390 0.2294 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5564 -0.4935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5564 -1.2906 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0063 1.3075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0063 2.1046 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0063 -2.1566 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0063 -1.3595 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4945 -2.3141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7214 -3.1610 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5683 -2.9341 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8407 4.0154 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3421 2.5856 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1750 4.0282 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9928 1.4266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 0.7995 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0072 0.1867 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 2 0 0 0 0 2 15 2 0 0 0 0 3 23 1 0 0 0 0 3 26 1 0 0 0 0 4 27 1 0 0 0 0 4 32 1 0 0 0 0 5 14 1 0 0 0 0 5 15 1 0 0 0 0 5 16 1 0 0 0 0 19 6 1 1 0 0 0 6 20 1 0 0 0 0 6 22 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 12 1 0 0 0 0 7 13 1 0 0 0 0 8 10 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 9 11 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 10 11 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 12 14 1 0 0 0 0 12 41 1 0 0 0 0 12 42 1 0 0 0 0 13 15 1 0 0 0 0 13 43 1 0 0 0 0 13 44 1 0 0 0 0 16 17 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 17 48 1 0 0 0 0 18 20 1 0 0 0 0 18 49 1 0 0 0 0 18 50 1 0 0 0 0 19 21 1 0 0 0 0 19 23 1 0 0 0 0 19 51 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 21 24 1 0 0 0 0 21 54 1 0 0 0 0 21 55 1 0 0 0 0 22 25 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 24 26 2 0 0 0 0 24 27 1 0 0 0 0 25 28 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 26 29 1 0 0 0 0 27 30 2 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 31 2 0 0 0 0 29 65 1 0 0 0 0 30 31 1 0 0 0 0 30 66 1 0 0 0 0 31 67 1 0 0 0 0 32 68 1 0 0 0 0 32 69 1 0 0 0 0 32 70 1 0 0 0 0 M END $$$$