D00TSX -OEChem-10101305022D 126131 0 1 0 0 0 0 0999 V2000 7.7023 0.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5683 0.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -2.4400 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.7023 2.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.5683 1.5600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9702 2.0600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9114 1.1733 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8362 -1.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4343 -0.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3004 1.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5683 3.5600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.2382 -0.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9702 3.0600 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1282 2.5295 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1094 5.1478 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.3004 -4.4400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6106 -0.5323 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8004 6.0988 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.1664 -5.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4343 -5.9400 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5683 -1.4400 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.9702 -0.9400 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 10.3004 0.5600 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.6282 -0.0003 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5683 -2.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8362 3.5600 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 9.4343 3.0600 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.8362 4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7023 -0.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1664 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2382 0.0600 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6282 0.9997 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4343 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 -1.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4343 -2.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9702 5.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.7023 3.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4343 2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3004 3.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8235 1.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0324 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9702 2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4329 1.5833 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1341 2.5338 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9702 6.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4343 -3.9400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3004 4.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2534 0.2336 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8984 0.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8450 1.3771 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0324 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4663 3.2781 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7645 0.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1042 6.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.7645 1.5600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8984 2.0600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1771 2.1214 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4878 3.0719 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4913 5.1478 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6584 0.0253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.6584 2.0947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8004 6.0988 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5645 0.5392 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 15.5645 1.5808 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3004 -5.4400 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1052 -1.7500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4452 -0.5415 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8373 0.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0589 0.2453 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2388 0.1074 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9577 -2.3323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3562 -3.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2993 3.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4343 3.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4468 4.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0483 5.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8362 -2.0600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7679 -0.4149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5649 -0.4149 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9713 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7632 -0.3385 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3162 -0.0226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7148 0.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0449 -3.0477 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6464 -2.3574 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8373 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3596 5.1677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7582 4.4774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.5124 2.9774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9109 3.6677 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5683 4.1800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8922 2.1426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4936 1.4523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7012 -1.2500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4333 3.3700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0223 1.3907 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5808 5.9523 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1823 6.6426 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8238 -3.8323 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2223 -4.5226 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6955 2.7797 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8984 -0.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6524 0.7878 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4955 1.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6589 3.8674 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4142 7.0969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5673 6.8700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7942 6.0231 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8984 2.6800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5704 1.9935 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6990 4.9562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0737 3.5334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9017 4.9562 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.4247 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8226 -1.1150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6512 -0.5946 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6512 2.7146 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1648 6.6004 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1002 0.2271 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 16.1002 1.8929 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1664 -6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.7033 -5.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4343 -6.5600 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8974 -5.6300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 2 0 0 0 0 2 33 2 0 0 0 0 3 34 2 0 0 0 0 4 38 2 0 0 0 0 5 39 2 0 0 0 0 6 44 2 0 0 0 0 7 50 2 0 0 0 0 8 22 1 0 0 0 0 8 29 1 0 0 0 0 8 79 1 0 0 0 0 9 21 1 0 0 0 0 9 33 1 0 0 0 0 9 82 1 0 0 0 0 10 23 1 0 0 0 0 10 39 1 0 0 0 0 10 88 1 0 0 0 0 11 27 1 0 0 0 0 11 38 1 0 0 0 0 11 93 1 0 0 0 0 12 31 1 0 0 0 0 12 34 1 0 0 0 0 12 96 1 0 0 0 0 13 26 1 0 0 0 0 13 44 1 0 0 0 0 13 97 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 14103 1 0 0 0 0 15 49 1 0 0 0 0 15 64 1 0 0 0 0 15113 1 0 0 0 0 16 48 1 0 0 0 0 16 67 2 0 0 0 0 17 50 1 0 0 0 0 17116 1 0 0 0 0 17117 1 0 0 0 0 18 61 1 0 0 0 0 18 64 2 0 0 0 0 19 67 1 0 0 0 0 19123 1 0 0 0 0 19124 1 0 0 0 0 20 67 1 0 0 0 0 20125 1 0 0 0 0 20126 1 0 0 0 0 21 25 1 1 0 0 0 21 29 1 0 0 0 0 21 68 1 0 0 0 0 22 24 1 6 0 0 0 22 34 1 0 0 0 0 22 69 1 0 0 0 0 23 30 1 6 0 0 0 23 33 1 0 0 0 0 23 70 1 0 0 0 0 24 32 1 0 0 0 0 24 71 1 0 0 0 0 24 72 1 0 0 0 0 25 36 1 0 0 0 0 25 73 1 0 0 0 0 25 74 1 0 0 0 0 26 28 1 1 0 0 0 26 38 1 0 0 0 0 26 75 1 0 0 0 0 27 39 1 0 0 0 0 27 40 1 1 0 0 0 27 76 1 0 0 0 0 28 37 1 0 0 0 0 28 77 1 0 0 0 0 28 78 1 0 0 0 0 30 43 1 0 0 0 0 30 80 1 0 0 0 0 30 81 1 0 0 0 0 31 35 1 0 0 0 0 31 50 1 6 0 0 0 31 83 1 0 0 0 0 32 42 1 0 0 0 0 32 45 2 0 0 0 0 35 41 1 0 0 0 0 35 84 1 0 0 0 0 35 85 1 0 0 0 0 36 48 1 0 0 0 0 36 86 1 0 0 0 0 36 87 1 0 0 0 0 37 47 1 0 0 0 0 37 89 1 0 0 0 0 37 90 1 0 0 0 0 40 49 1 0 0 0 0 40 91 1 0 0 0 0 40 92 1 0 0 0 0 41 44 1 0 0 0 0 41 94 1 0 0 0 0 41 95 1 0 0 0 0 42 46 1 0 0 0 0 42 52 2 0 0 0 0 43 51 2 0 0 0 0 43 53 1 0 0 0 0 45 98 1 0 0 0 0 46 54 2 0 0 0 0 47 56 1 0 0 0 0 47 99 1 0 0 0 0 47100 1 0 0 0 0 48101 1 0 0 0 0 48102 1 0 0 0 0 49 61 2 0 0 0 0 51 55 1 0 0 0 0 51104 1 0 0 0 0 52 59 1 0 0 0 0 52105 1 0 0 0 0 53 58 2 0 0 0 0 53106 1 0 0 0 0 54 60 1 0 0 0 0 54107 1 0 0 0 0 55 57 1 0 0 0 0 55 62 2 0 0 0 0 56108 1 0 0 0 0 56109 1 0 0 0 0 56110 1 0 0 0 0 57 58 1 0 0 0 0 57 63 2 0 0 0 0 58111 1 0 0 0 0 59 60 2 0 0 0 0 59112 1 0 0 0 0 60114 1 0 0 0 0 61115 1 0 0 0 0 62 65 1 0 0 0 0 62118 1 0 0 0 0 63 66 1 0 0 0 0 63119 1 0 0 0 0 64120 1 0 0 0 0 65 66 2 0 0 0 0 65121 1 0 0 0 0 66122 1 0 0 0 0 M END $$$$