BI6H0M -OEChem-04022105233D 86 88 0 1 0 0 0 0 0999 V2000 3.5777 0.0404 -0.9266 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2525 -0.7519 0.4408 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0955 0.6423 0.7957 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5141 -0.5110 -1.0647 O 0 0 0 0 0 0 0 0 0 0 0 0 1.3066 0.6853 -2.5745 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4023 1.0599 1.8269 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.2810 -2.7557 -1.1407 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4352 -1.7835 0.8035 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3851 2.3483 -1.1652 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6116 0.2478 -2.4725 O 0 0 0 0 0 0 0 0 0 0 0 0 7.6971 -1.7017 -0.3556 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8260 -1.6809 -2.0279 O 0 0 0 0 0 0 0 0 0 0 0 0 -6.5433 -0.7839 0.4834 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.9643 -2.5387 2.1317 O 0 0 0 0 0 0 0 0 0 0 0 0 5.2218 -0.9006 3.0414 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8427 -4.6855 0.1426 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0943 3.5091 -0.0632 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.1650 3.2083 -0.6213 N 0 3 0 0 0 0 0 0 0 0 0 0 -7.1501 2.9336 -1.1263 N 0 5 0 0 0 0 0 0 0 0 0 0 2.2724 0.3058 -0.4190 C 0 0 1 0 0 0 0 0 0 0 0 0 1.2132 -0.1508 -1.4236 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.1860 -0.0448 -0.8020 C 0 0 1 0 0 0 0 0 0 0 0 0 2.1045 -0.3991 0.9277 C 0 0 1 0 0 0 0 0 0 0 0 0 0.6667 -0.2820 1.4328 C 0 0 2 0 0 0 0 0 0 0 0 0 4.5212 1.0011 -0.4657 C 0 0 1 0 0 0 0 0 0 0 0 0 5.6153 1.1965 -1.5151 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5184 -0.0345 -1.6023 C 0 0 2 0 0 0 0 0 0 0 0 0 -1.2604 -0.6370 -1.7098 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0356 -0.4458 -0.2227 C 0 0 1 0 0 0 0 0 0 0 0 0 5.8682 -0.5621 0.7668 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4758 -1.4137 -1.5997 C 0 0 1 0 0 0 0 0 0 0 0 0 -4.8850 -0.9307 -1.2576 C 0 0 2 0 0 0 0 0 0 0 0 0 -5.1747 -1.0960 0.2349 C 0 0 2 0 0 0 0 0 0 0 0 0 -4.8634 -2.5165 0.7097 C 0 0 1 0 0 0 0 0 0 0 0 0 -3.4502 -2.9230 0.2707 C 0 0 1 0 0 0 0 0 0 0 0 0 6.3512 -0.8164 2.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7135 1.1341 2.7026 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1540 -4.3868 0.5848 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9301 2.5868 3.1020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1868 3.4734 1.8853 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4057 2.9946 1.0943 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6809 3.9048 -0.1062 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8995 3.4606 -0.9074 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1305 1.3868 -0.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4253 -1.1777 -1.7434 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4472 1.0053 -0.6183 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7911 0.0342 1.6619 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5534 -0.9475 2.2979 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0449 1.9771 -0.3129 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1784 1.3900 -2.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9667 -0.8713 -2.0489 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0342 -1.6959 -1.8885 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2973 -0.1153 -2.6721 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7769 0.2821 0.1273 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2072 -1.3923 0.4864 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3773 -1.4410 -2.6926 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0135 0.1229 -1.5319 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5770 -0.3790 0.8123 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6134 -3.2118 0.3148 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6951 -2.3134 0.7842 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0837 1.5933 -2.3072 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9739 0.0121 2.5456 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9174 -1.7501 2.2614 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3684 -2.1819 1.6880 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7882 3.1159 -1.1779 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6036 0.6896 2.2466 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4925 0.5610 3.6115 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8451 -5.0472 0.0505 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2200 -4.5862 1.6587 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2418 0.4979 -3.3364 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0388 -2.3613 -0.6334 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0376 2.9622 3.6168 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7691 2.6550 3.8037 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6388 -1.5107 -2.9668 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6971 0.1257 0.1755 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2797 -1.9494 2.4916 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3039 3.4937 1.2354 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3502 4.5025 2.2274 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5513 -1.0592 3.9424 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2560 1.9808 0.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2775 2.9680 1.7584 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6761 -5.6209 0.3494 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8054 3.9145 -0.7666 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8327 4.9329 0.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0234 4.1256 -1.7707 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7460 2.4431 -1.2869 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 25 1 0 0 0 0 2 22 1 0 0 0 0 2 24 1 0 0 0 0 3 25 1 0 0 0 0 3 30 1 0 0 0 0 4 28 1 0 0 0 0 4 31 1 0 0 0 0 5 21 1 0 0 0 0 5 61 1 0 0 0 0 6 24 1 0 0 0 0 6 37 1 0 0 0 0 7 31 1 0 0 0 0 7 35 1 0 0 0 0 8 23 1 0 0 0 0 8 64 1 0 0 0 0 9 26 1 0 0 0 0 9 65 1 0 0 0 0 10 27 1 0 0 0 0 10 70 1 0 0 0 0 11 29 1 0 0 0 0 11 71 1 0 0 0 0 12 32 1 0 0 0 0 12 74 1 0 0 0 0 13 33 1 0 0 0 0 13 75 1 0 0 0 0 14 34 1 0 0 0 0 14 76 1 0 0 0 0 15 36 1 0 0 0 0 15 79 1 0 0 0 0 16 38 1 0 0 0 0 16 82 1 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 2 0 0 0 0 20 21 1 0 0 0 0 20 23 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 28 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 26 27 1 0 0 0 0 26 50 1 0 0 0 0 27 29 1 0 0 0 0 27 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 29 30 1 0 0 0 0 29 54 1 0 0 0 0 30 36 1 0 0 0 0 30 55 1 0 0 0 0 31 32 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 33 34 1 0 0 0 0 33 58 1 0 0 0 0 34 35 1 0 0 0 0 34 59 1 0 0 0 0 35 38 1 0 0 0 0 35 60 1 0 0 0 0 36 62 1 0 0 0 0 36 63 1 0 0 0 0 37 39 1 0 0 0 0 37 66 1 0 0 0 0 37 67 1 0 0 0 0 38 68 1 0 0 0 0 38 69 1 0 0 0 0 39 40 1 0 0 0 0 39 72 1 0 0 0 0 39 73 1 0 0 0 0 40 41 1 0 0 0 0 40 77 1 0 0 0 0 40 78 1 0 0 0 0 41 42 1 0 0 0 0 41 80 1 0 0 0 0 41 81 1 0 0 0 0 42 43 1 0 0 0 0 42 83 1 0 0 0 0 42 84 1 0 0 0 0 43 85 1 0 0 0 0 43 86 1 0 0 0 0 M CHG 2 18 1 19 -1 M END $$$$