L5YP6I -OEChem-05032301173D 88 93 0 1 0 0 0 0 0999 V2000 4.7465 0.4386 2.4664 F 0 0 0 0 0 0 0 0 0 0 0 0 -0.3735 3.3812 1.9941 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1377 3.7915 0.3377 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7824 0.5464 1.0257 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.6211 -2.2825 -0.0001 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0723 -1.6866 -1.5773 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0744 0.2535 -1.1533 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.9440 -0.1373 -0.0633 N 0 0 0 0 0 0 0 0 0 0 0 0 1.7432 -2.2361 -0.6619 N 0 0 0 0 0 0 0 0 0 0 0 0 7.7475 -0.4010 0.6216 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1069 -1.7066 -1.3048 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2226 4.2544 -0.0321 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8211 5.4763 0.7157 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7780 4.6967 -1.4521 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9179 6.7115 0.7002 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0992 5.9510 -1.4661 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5462 7.1097 -0.7206 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1834 3.0555 -0.1353 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0108 3.7945 0.7553 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8026 1.8290 -0.6899 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4573 3.2175 0.4131 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3976 1.6477 -1.2339 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7491 0.7905 -0.7302 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3659 2.1567 0.4162 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0210 0.9324 -0.1621 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5763 -0.2117 0.0672 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7907 -1.7113 0.2895 C 0 0 1 0 0 0 0 0 0 0 0 0 -0.0171 -0.5243 -2.3877 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5190 -2.4708 0.4289 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4621 -4.3238 0.7748 C 0 0 2 0 0 0 0 0 0 0 0 0 -3.0660 -3.7159 0.7305 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8139 -1.3851 -0.6486 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8913 -3.5528 -0.3771 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1482 -4.1591 -0.2340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4215 -2.0631 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3979 -3.6830 -0.2766 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6723 -2.6705 1.5734 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0961 -1.9807 -0.5961 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1111 -4.2987 2.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4197 -5.3234 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6046 -1.1793 0.4275 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9531 -2.5229 -1.5510 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9806 -0.9100 0.5073 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8450 -1.4606 -0.4613 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3225 -2.2660 -1.4867 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5210 -0.1101 1.5210 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2064 -1.1709 -0.3493 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8901 0.1090 1.5313 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0567 5.2428 1.7619 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7576 5.7873 0.2327 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2157 3.9432 -2.0003 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6742 4.8974 -2.0562 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0088 6.5208 1.2828 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4343 7.5461 1.1886 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2722 6.2511 -2.5069 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0890 5.7500 -1.0446 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4452 7.4361 -1.2578 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1394 7.9643 -0.6991 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8083 4.1281 0.8826 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4025 1.9226 -2.2949 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3913 2.1934 -0.7625 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4491 -0.1565 -1.1596 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3408 2.2969 0.8774 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3973 3.0755 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2231 -1.8332 1.2931 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7413 0.0068 0.5509 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2342 -1.5715 -2.1962 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9379 -0.4390 -2.9136 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8151 -0.1340 -3.0268 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3789 -5.3900 0.5308 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4143 -2.7446 -1.4736 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2111 -3.9268 -1.1368 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1678 -1.2400 2.0910 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0326 -3.8240 -1.2988 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3807 -4.1666 -0.2354 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3406 -2.2797 2.3351 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3549 -3.2830 2.4933 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0458 -4.8706 2.1591 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4513 -4.7489 2.9149 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5586 -6.2368 -0.5494 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3034 -5.1477 -1.7555 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5906 -5.5155 -1.8275 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9772 -0.7459 1.1981 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5677 -3.1468 -2.3537 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9484 -2.7036 -2.2591 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3460 0.7234 2.3008 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9370 -2.6404 -1.6565 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0779 -1.4394 -1.1897 H 0 0 0 0 0 0 0 0 0 0 0 0 1 46 1 0 0 0 0 2 19 1 0 0 0 0 2 64 1 0 0 0 0 3 19 2 0 0 0 0 4 26 2 0 0 0 0 5 32 1 0 0 0 0 5 36 1 0 0 0 0 6 32 2 0 0 0 0 7 22 1 0 0 0 0 7 26 1 0 0 0 0 7 28 1 0 0 0 0 8 25 1 0 0 0 0 8 32 1 0 0 0 0 8 66 1 0 0 0 0 9 27 1 0 0 0 0 9 38 1 0 0 0 0 9 71 1 0 0 0 0 10 47 2 0 0 0 0 10 48 1 0 0 0 0 11 47 1 0 0 0 0 11 87 1 0 0 0 0 11 88 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 18 1 0 0 0 0 12 19 1 0 0 0 0 13 15 1 0 0 0 0 13 49 1 0 0 0 0 13 50 1 0 0 0 0 14 16 1 0 0 0 0 14 51 1 0 0 0 0 14 52 1 0 0 0 0 15 17 1 0 0 0 0 15 53 1 0 0 0 0 15 54 1 0 0 0 0 16 17 1 0 0 0 0 16 55 1 0 0 0 0 16 56 1 0 0 0 0 17 57 1 0 0 0 0 17 58 1 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 20 22 1 0 0 0 0 20 23 1 0 0 0 0 21 24 2 0 0 0 0 21 59 1 0 0 0 0 22 60 1 0 0 0 0 22 61 1 0 0 0 0 23 25 2 0 0 0 0 23 62 1 0 0 0 0 24 25 1 0 0 0 0 24 63 1 0 0 0 0 26 27 1 0 0 0 0 27 29 1 0 0 0 0 27 65 1 0 0 0 0 28 67 1 0 0 0 0 28 68 1 0 0 0 0 28 69 1 0 0 0 0 29 33 2 0 0 0 0 29 35 1 0 0 0 0 30 31 1 0 0 0 0 30 36 1 0 0 0 0 30 39 1 0 0 0 0 30 70 1 0 0 0 0 31 34 2 0 0 0 0 31 37 1 0 0 0 0 33 34 1 0 0 0 0 33 72 1 0 0 0 0 34 40 1 0 0 0 0 35 37 2 0 0 0 0 35 73 1 0 0 0 0 36 74 1 0 0 0 0 36 75 1 0 0 0 0 37 76 1 0 0 0 0 38 41 2 0 0 0 0 38 42 1 0 0 0 0 39 77 1 0 0 0 0 39 78 1 0 0 0 0 39 79 1 0 0 0 0 40 80 1 0 0 0 0 40 81 1 0 0 0 0 40 82 1 0 0 0 0 41 43 1 0 0 0 0 41 83 1 0 0 0 0 42 45 2 0 0 0 0 42 84 1 0 0 0 0 43 44 2 0 0 0 0 43 46 1 0 0 0 0 44 45 1 0 0 0 0 44 47 1 0 0 0 0 45 85 1 0 0 0 0 46 48 2 0 0 0 0 48 86 1 0 0 0 0 M END $$$$