B46EOG -OEChem-04022105072D 109112 0 1 0 0 0 0 0999 V2000 2.8660 2.7751 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.8661 -3.2249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 0.7751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -0.2249 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 4.2751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 6.7751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 5.2751 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -3.2249 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.2751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.2751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.7751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 4.2751 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -4.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5683 -6.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -6.6083 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8959 -6.1732 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5683 -5.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0410 -5.5630 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8959 -5.2077 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 -7.0851 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -6.4760 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0591 -6.6560 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 -3.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3302 -0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.7751 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.4641 1.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 0.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 1.2751 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5981 2.7751 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 8.9282 2.2751 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.7942 2.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7321 2.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 2.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6603 1.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 3.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 0.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 5.2751 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 5.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 1.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5263 -0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 5.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 6.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 5.2751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2583 0.7751 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -0.7249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2584 -0.2249 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1607 -6.3559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9069 -7.2136 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4034 -5.8172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1788 -5.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7803 -4.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6974 -5.0470 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4476 -5.7425 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6838 -4.6251 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2853 -5.3153 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6372 -7.6224 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4718 -7.4147 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3621 -6.9735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1020 -6.9735 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5778 -6.2651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8659 -7.2451 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -3.5349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3860 -1.6423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9875 -2.3326 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6762 -2.3075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0747 -1.6172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2521 -0.1423 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8535 -0.8325 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5422 -0.8075 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9407 -0.1172 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.8951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 2.5851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4652 1.5851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 3.0851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 2.8951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 0.1551 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0063 2.1925 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4048 2.8828 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3722 3.3121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5252 3.0851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7522 2.2382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3335 1.8002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1306 1.8002 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0588 1.7501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2617 1.7501 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4142 3.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7942 4.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1742 3.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 3.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 4.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 2.4651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 6.0851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 1.8951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9894 -0.5349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2181 6.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 7.3951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9781 6.7751 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1541 4.7382 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 4.9651 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7741 5.8121 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 1.0852 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.3923 -1.3449 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.7953 -0.5349 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 7.0851 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 35 1 0 0 0 0 1 96 1 0 0 0 0 2 23 2 0 0 0 0 3 29 2 0 0 0 0 4 30 2 0 0 0 0 5 37 2 0 0 0 0 6 45 1 0 0 0 0 6109 1 0 0 0 0 7 45 2 0 0 0 0 8 23 1 0 0 0 0 8 24 1 0 0 0 0 8 66 1 0 0 0 0 28 9 1 1 0 0 0 9 30 1 0 0 0 0 9 76 1 0 0 0 0 10 29 1 0 0 0 0 32 10 1 1 0 0 0 10 77 1 0 0 0 0 31 11 1 6 0 0 0 11 38 1 0 0 0 0 11 81 1 0 0 0 0 12 37 1 0 0 0 0 41 12 1 6 0 0 0 12 94 1 0 0 0 0 13 17 1 0 0 0 0 13 18 1 0 0 0 0 13 19 1 0 0 0 0 13 23 1 0 0 0 0 14 17 1 0 0 0 0 14 20 1 0 0 0 0 14 21 1 0 0 0 0 14 51 1 0 0 0 0 15 18 1 0 0 0 0 15 20 1 0 0 0 0 15 22 1 0 0 0 0 15 52 1 0 0 0 0 16 19 1 0 0 0 0 16 21 1 0 0 0 0 16 22 1 0 0 0 0 16 53 1 0 0 0 0 17 54 1 0 0 0 0 17 55 1 0 0 0 0 18 56 1 0 0 0 0 18 57 1 0 0 0 0 19 58 1 0 0 0 0 19 59 1 0 0 0 0 20 60 1 0 0 0 0 20 61 1 0 0 0 0 21 62 1 0 0 0 0 21 63 1 0 0 0 0 22 64 1 0 0 0 0 22 65 1 0 0 0 0 24 25 1 0 0 0 0 24 67 1 0 0 0 0 24 68 1 0 0 0 0 25 26 1 0 0 0 0 25 69 1 0 0 0 0 25 70 1 0 0 0 0 26 27 1 0 0 0 0 26 71 1 0 0 0 0 26 72 1 0 0 0 0 27 28 1 0 0 0 0 27 73 1 0 0 0 0 27 74 1 0 0 0 0 28 29 1 0 0 0 0 28 75 1 0 0 0 0 30 31 1 0 0 0 0 31 33 1 0 0 0 0 31 78 1 0 0 0 0 32 35 1 0 0 0 0 32 37 1 0 0 0 0 32 79 1 0 0 0 0 33 34 1 0 0 0 0 33 36 1 6 0 0 0 33 80 1 0 0 0 0 34 39 1 0 0 0 0 34 82 1 0 0 0 0 34 83 1 0 0 0 0 35 87 1 0 0 0 0 35 88 1 0 0 0 0 36 84 1 0 0 0 0 36 85 1 0 0 0 0 36 86 1 0 0 0 0 38 40 1 0 0 0 0 38 89 1 0 0 0 0 38 90 1 0 0 0 0 39 91 1 0 0 0 0 39 92 1 0 0 0 0 39 93 1 0 0 0 0 40 43 2 0 0 0 0 40 44 1 0 0 0 0 41 42 1 0 0 0 0 41 45 1 0 0 0 0 41 95 1 0 0 0 0 42 46 1 0 0 0 0 42 47 1 0 0 0 0 42 97 1 0 0 0 0 43 48 1 0 0 0 0 43 98 1 0 0 0 0 44 49 2 0 0 0 0 44 99 1 0 0 0 0 46100 1 0 0 0 0 46101 1 0 0 0 0 46102 1 0 0 0 0 47103 1 0 0 0 0 47104 1 0 0 0 0 47105 1 0 0 0 0 48 50 2 0 0 0 0 48106 1 0 0 0 0 49 50 1 0 0 0 0 49107 1 0 0 0 0 50108 1 0 0 0 0 M END $$$$