B4ZO3K -OEChem-04022102122D 84 87 0 1 0 0 0 0 0999 V2000 4.5884 -0.2429 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5884 -2.2912 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 10.7166 -4.7671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1186 -3.2671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.8506 -0.2671 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 11.9978 0.3952 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.9846 -1.7671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1186 -0.2671 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8680 2.7637 0.0000 N 0 0 3 0 0 0 0 0 0 0 0 0 8.9846 -3.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9846 -4.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8506 -3.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.8506 -5.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7166 -3.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1186 -2.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.5826 -5.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7759 0.7301 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6768 -0.8304 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5089 1.4103 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6324 -0.5356 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.4978 1.2613 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9846 -0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2525 -1.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2525 -0.7671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9950 0.4700 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3586 -2.3017 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3586 -0.2324 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4525 -1.7879 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4525 -0.7462 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7282 1.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5923 0.7571 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.2604 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8718 3.7637 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0077 4.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5923 -3.2912 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0116 5.2671 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9846 -3.1471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.3740 -4.6594 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7725 -5.3497 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2491 -2.7921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4521 -2.7921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4521 -5.7420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2491 -5.7420 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.3272 -3.8747 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9287 -3.1844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5816 -3.5771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.2726 -5.8040 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1196 -5.5771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8926 -4.7301 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4659 1.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1834 0.5474 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2223 -1.2521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9868 -1.3673 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7354 1.9875 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9966 1.7596 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6787 -1.1539 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2455 -0.6280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.0902 1.4440 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4514 1.8795 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0413 -0.1483 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6132 0.5163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.9486 1.0882 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3658 -2.9217 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3658 0.3876 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 1.3704 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5139 0.6786 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2024 0.6471 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8066 1.3389 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3422 2.1504 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9463 2.8422 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4820 3.6537 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0861 4.3455 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3976 4.3771 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7934 3.6853 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6921 2.8052 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4619 1.9592 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3079 1.7290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9723 -3.2936 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5947 -3.9112 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2123 -3.2888 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6316 5.2647 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 5.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3916 5.2694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 29 1 0 0 0 0 1 31 1 0 0 0 0 2 28 1 0 0 0 0 2 36 1 0 0 0 0 3 13 1 0 0 0 0 3 14 1 0 0 0 0 3 16 1 0 0 0 0 4 10 1 0 0 0 0 4 15 1 0 0 0 0 4 47 1 0 0 0 0 5 17 1 0 0 0 0 5 18 1 0 0 0 0 5 22 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 6 25 1 0 0 0 0 7 15 2 0 0 0 0 7 22 1 0 0 0 0 8 22 2 0 0 0 0 8 24 1 0 0 0 0 9 32 1 0 0 0 0 9 33 1 0 0 0 0 9 35 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 38 1 0 0 0 0 11 13 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 43 1 0 0 0 0 13 44 1 0 0 0 0 14 45 1 0 0 0 0 14 46 1 0 0 0 0 15 23 1 0 0 0 0 16 48 1 0 0 0 0 16 49 1 0 0 0 0 16 50 1 0 0 0 0 17 19 1 0 0 0 0 17 51 1 0 0 0 0 17 52 1 0 0 0 0 18 20 1 0 0 0 0 18 53 1 0 0 0 0 18 54 1 0 0 0 0 19 21 1 0 0 0 0 19 55 1 0 0 0 0 19 56 1 0 0 0 0 20 57 1 0 0 0 0 20 58 1 0 0 0 0 21 59 1 0 0 0 0 21 60 1 0 0 0 0 23 24 1 0 0 0 0 23 26 2 0 0 0 0 24 27 2 0 0 0 0 25 61 1 0 0 0 0 25 62 1 0 0 0 0 25 63 1 0 0 0 0 26 28 1 0 0 0 0 26 64 1 0 0 0 0 27 29 1 0 0 0 0 27 65 1 0 0 0 0 28 29 2 0 0 0 0 30 31 1 0 0 0 0 30 32 1 0 0 0 0 30 66 1 0 0 0 0 30 67 1 0 0 0 0 31 68 1 0 0 0 0 31 69 1 0 0 0 0 32 70 1 0 0 0 0 32 71 1 0 0 0 0 33 34 1 0 0 0 0 33 72 1 0 0 0 0 33 73 1 0 0 0 0 34 37 1 0 0 0 0 34 74 1 0 0 0 0 34 75 1 0 0 0 0 35 76 1 0 0 0 0 35 77 1 0 0 0 0 35 78 1 0 0 0 0 36 79 1 0 0 0 0 36 80 1 0 0 0 0 36 81 1 0 0 0 0 37 82 1 0 0 0 0 37 83 1 0 0 0 0 37 84 1 0 0 0 0 M END $$$$