D05WZF -OEChem-10101305022D 79 81 0 1 0 0 0 0 0999 V2000 3.5000 3.9820 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -7.4462 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -1.2141 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 -0.3481 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 2.2500 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.0000 3.1160 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6340 3.4820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3660 4.4820 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 0.5179 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 3.1160 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 3.9820 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 4.8481 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.0000 6.5801 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -2.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.0000 -3.8122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3660 -2.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8660 -3.3122 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -3.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -2.0801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -4.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -4.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -4.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 -0.3481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7680 -5.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 -5.9462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6340 -6.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 1.3840 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.0000 1.3840 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5000 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 2.2500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0000 3.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 3.1160 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 4.8481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.8481 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5000 5.7141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 5.7141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0000 6.5801 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 5.7141 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5000 7.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5000 7.4462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9030 -2.1362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0560 -1.9092 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4631 -4.1222 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3100 -4.3491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1760 -3.8491 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4030 -3.0022 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4219 -2.8635 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0234 -3.5538 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 -1.6816 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 -2.4787 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 -4.6362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0369 -4.6362 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 -6.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0369 -6.2562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1200 0.5179 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6200 1.3840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4174 1.1719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1077 0.7734 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0826 2.4620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3923 2.8606 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9174 2.0380 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6077 1.6394 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5826 3.3281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8923 3.7266 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6900 2.5791 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1200 3.9820 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 5.2466 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5250 4.4496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.4681 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 4.8481 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.2281 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0369 5.4041 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8100 6.2510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9631 6.0241 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3800 6.5801 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8100 5.1772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1900 7.9831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8100 7.9831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 1 8 2 0 0 0 0 1 10 1 0 0 0 0 1 12 1 0 0 0 0 2 26 1 0 0 0 0 3 19 1 0 0 0 0 3 23 1 0 0 0 0 4 23 2 0 0 0 0 5 30 2 0 0 0 0 6 33 2 0 0 0 0 9 23 1 0 0 0 0 27 9 1 1 0 0 0 9 56 1 0 0 0 0 10 32 1 0 0 0 0 10 66 1 0 0 0 0 11 33 1 0 0 0 0 11 34 1 0 0 0 0 11 67 1 0 0 0 0 12 35 1 0 0 0 0 12 36 1 0 0 0 0 13 39 1 0 0 0 0 13 41 2 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 18 1 0 0 0 0 14 19 1 0 0 0 0 15 17 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 42 1 0 0 0 0 16 43 1 0 0 0 0 17 46 1 0 0 0 0 17 47 1 0 0 0 0 18 20 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 21 24 1 0 0 0 0 21 52 1 0 0 0 0 22 25 2 0 0 0 0 22 53 1 0 0 0 0 24 26 2 0 0 0 0 24 54 1 0 0 0 0 25 26 1 0 0 0 0 25 55 1 0 0 0 0 27 28 1 0 0 0 0 27 30 1 0 0 0 0 27 57 1 0 0 0 0 28 29 1 0 0 0 0 28 58 1 0 0 0 0 28 59 1 0 0 0 0 29 31 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 31 63 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 34 37 1 0 0 0 0 34 68 1 0 0 0 0 34 69 1 0 0 0 0 35 70 1 0 0 0 0 35 71 1 0 0 0 0 35 72 1 0 0 0 0 36 73 1 0 0 0 0 36 74 1 0 0 0 0 36 75 1 0 0 0 0 37 38 1 0 0 0 0 37 39 2 0 0 0 0 38 40 2 0 0 0 0 38 76 1 0 0 0 0 39 77 1 0 0 0 0 40 41 1 0 0 0 0 40 78 1 0 0 0 0 41 79 1 0 0 0 0 M END $$$$