D04WJO -OEChem-10101305032D 93 97 0 1 0 0 0 0 0999 V2000 9.8284 4.9342 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0999 5.0444 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.7858 3.3059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6863 -0.2017 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7350 1.1768 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8670 3.4157 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1018 4.6303 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6002 2.4519 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0347 0.7752 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4096 0.4482 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.9449 -0.9213 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9397 -0.9213 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4431 -2.2908 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5043 3.2045 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9090 2.0504 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9102 2.0504 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 7.6077 1.0828 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9726 3.0484 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2451 1.1162 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4858 2.8682 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6400 0.8149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8687 3.4923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2127 0.8149 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3721 -0.1528 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9387 1.5278 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5124 -0.1193 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4044 -0.4207 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4818 -0.3872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9324 4.4903 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4044 -1.4218 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3721 -1.6897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5459 -1.6562 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4818 -1.3884 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2055 2.4916 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6412 -2.9253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2451 -2.8918 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6735 -2.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2462 -2.6239 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9425 -3.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9437 -3.8595 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2775 0.2185 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5384 -1.9219 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6086 0.1848 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2718 -4.6012 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.2803 -1.9904 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5362 2.9536 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.5364 -4.6649 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2695 1.9898 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5788 -5.5529 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8350 3.6665 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2009 -1.5999 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3014 1.7390 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2994 2.1631 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5246 1.9672 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7981 3.6433 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3565 2.9798 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9928 2.5113 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8427 3.3752 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9788 3.2250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0433 2.8974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4849 3.5609 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6493 1.2552 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 1.7944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5789 1.0229 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3252 -0.9428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2373 -3.0646 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6760 -3.0708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6530 -0.2749 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7708 0.5940 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9020 0.7118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4350 -1.6708 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2284 -1.3849 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0015 -2.2319 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8484 -2.4588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6697 3.8020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8911 -4.1118 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7238 -4.8911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2046 -2.6057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7016 3.5511 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8679 5.5529 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0371 -5.0324 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9040 -5.1642 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0358 -4.2974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3184 1.3718 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8866 1.9307 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9887 -5.7432 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7691 -6.1430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1688 -5.3626 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1928 0.1737 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6959 -1.9731 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2766 -0.9845 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4322 3.8577 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2964 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 80 1 0 0 0 0 2 29 2 0 0 0 0 3 34 2 0 0 0 0 4 43 1 0 0 0 0 4 89 1 0 0 0 0 5 43 2 0 0 0 0 6 50 1 0 0 0 0 6 92 1 0 0 0 0 7 50 2 0 0 0 0 8 52 1 0 0 0 0 8 93 1 0 0 0 0 9 52 2 0 0 0 0 10 17 2 0 0 0 0 10 19 1 0 0 0 0 11 26 1 0 0 0 0 11 32 1 0 0 0 0 11 65 1 0 0 0 0 12 24 1 0 0 0 0 12 31 2 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 13 71 1 0 0 0 0 14 34 1 0 0 0 0 46 14 1 1 0 0 0 14 75 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 1 0 0 0 15 53 1 0 0 0 0 16 19 1 0 0 0 0 16 20 1 6 0 0 0 16 54 1 0 0 0 0 17 21 1 0 0 0 0 18 22 1 0 0 0 0 18 55 1 0 0 0 0 18 56 1 0 0 0 0 19 23 2 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 20 59 1 0 0 0 0 21 24 2 0 0 0 0 21 25 1 0 0 0 0 22 29 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 26 1 0 0 0 0 23 62 1 0 0 0 0 24 27 1 0 0 0 0 25 34 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 26 28 2 0 0 0 0 27 30 2 0 0 0 0 27 43 1 0 0 0 0 28 33 1 0 0 0 0 28 41 1 0 0 0 0 30 31 1 0 0 0 0 30 42 1 0 0 0 0 31 37 1 0 0 0 0 32 33 2 0 0 0 0 32 38 1 0 0 0 0 33 45 1 0 0 0 0 35 37 2 0 0 0 0 35 39 1 0 0 0 0 36 38 2 0 0 0 0 36 40 1 0 0 0 0 37 66 1 0 0 0 0 38 67 1 0 0 0 0 39 40 2 0 0 0 0 39 44 1 0 0 0 0 40 47 1 0 0 0 0 41 68 1 0 0 0 0 41 69 1 0 0 0 0 41 70 1 0 0 0 0 42 72 1 0 0 0 0 42 73 1 0 0 0 0 42 74 1 0 0 0 0 44 49 1 0 0 0 0 44 76 1 0 0 0 0 44 77 1 0 0 0 0 45 51 2 0 0 0 0 45 78 1 0 0 0 0 46 48 1 0 0 0 0 46 50 1 0 0 0 0 46 79 1 0 0 0 0 47 81 1 0 0 0 0 47 82 1 0 0 0 0 47 83 1 0 0 0 0 48 52 1 0 0 0 0 48 84 1 0 0 0 0 48 85 1 0 0 0 0 49 86 1 0 0 0 0 49 87 1 0 0 0 0 49 88 1 0 0 0 0 51 90 1 0 0 0 0 51 91 1 0 0 0 0 M END $$$$