LEM95R -OEChem-05032300533D 79 80 0 1 0 0 0 0 0999 V2000 0.3384 0.7529 -3.6739 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4086 -2.2716 -0.1814 O 0 0 0 0 0 0 0 0 0 0 0 0 5.5268 -0.5457 0.6960 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1957 -1.7727 -1.1465 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0851 -0.8528 -1.2519 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.7331 0.7758 -1.6013 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7289 -2.8454 0.3051 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.6601 1.5975 0.8033 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6366 1.1814 1.6276 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8093 1.8099 0.1094 C 0 0 1 0 0 0 0 0 0 0 0 0 1.0113 1.6222 -1.2065 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2129 0.3129 -1.3364 C 0 0 1 0 0 0 0 0 0 0 0 0 2.5615 3.1612 0.0316 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5489 0.2827 -2.6623 C 0 0 1 0 0 0 0 0 0 0 0 0 3.3717 3.5787 1.2658 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8964 1.7352 1.3363 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4348 2.5836 1.7369 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7987 1.1623 -2.6496 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5414 2.3447 0.7067 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6826 -2.0663 -0.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7754 -3.1342 -0.7859 C 0 0 2 0 0 0 0 0 0 0 0 0 6.6915 1.4775 1.2418 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8958 1.6532 -1.5903 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2535 0.1008 1.7351 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1928 -4.5448 -0.7536 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8707 1.2782 -0.5059 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8628 -2.0741 0.0036 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6715 -1.5693 1.1833 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3677 -3.2615 1.6642 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0683 0.6067 -0.5405 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4940 0.5768 0.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.7259 -0.0257 1.3377 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5431 -1.5016 1.7462 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8281 -2.1285 2.2634 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5503 1.0050 0.1841 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3309 2.4754 -1.3158 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7405 1.6943 -2.0243 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4967 0.2269 -0.5085 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8344 3.9604 -0.1663 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2291 3.1455 -0.8390 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8334 -0.7455 -2.9195 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6869 3.7806 2.0979 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8587 4.5376 1.0466 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1148 2.5010 1.2941 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4576 1.8730 2.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4128 0.7572 1.4157 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9988 -0.7880 -1.6910 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9533 1.6387 2.0073 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8860 2.9773 2.6563 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2840 1.0892 -3.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5116 2.2154 -2.5427 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1218 1.8761 -0.1908 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9580 3.3088 0.3901 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2866 -3.0195 -1.7495 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0286 -0.1889 -1.7507 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2101 2.0042 2.0511 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4140 1.3475 0.4265 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1361 0.7152 -4.5218 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5863 2.6939 -1.4310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4145 1.6104 -2.5563 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1296 -0.5078 1.9837 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6450 0.2029 2.6408 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5574 -4.7151 0.1219 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9903 -5.2950 -0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5685 -4.7174 -1.6373 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9971 -1.1413 1.9316 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2655 -2.3874 1.6015 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 -2.7143 1.9760 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1688 -4.3359 1.6761 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1639 -3.0778 2.3862 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5599 0.1980 -1.4116 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8749 2.0952 1.2044 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5218 0.0415 0.5849 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0782 0.5476 2.2049 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.7698 -1.5768 2.5206 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1847 -2.0811 0.8863 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6560 -3.1726 2.5427 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1949 -1.5954 3.1462 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.6101 -2.1049 1.4979 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 58 1 0 0 0 0 2 20 2 0 0 0 0 3 24 1 0 0 0 0 3 28 1 0 0 0 0 4 27 2 0 0 0 0 5 12 1 0 0 0 0 5 20 1 0 0 0 0 5 47 1 0 0 0 0 6 18 1 0 0 0 0 6 23 1 0 0 0 0 6 55 1 0 0 0 0 7 21 1 0 0 0 0 7 27 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 26 1 0 0 0 0 8 72 1 0 0 0 0 9 31 2 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 10 16 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 36 1 0 0 0 0 11 37 1 0 0 0 0 12 14 1 0 0 0 0 12 38 1 0 0 0 0 13 15 1 0 0 0 0 13 39 1 0 0 0 0 13 40 1 0 0 0 0 14 18 1 0 0 0 0 14 41 1 0 0 0 0 15 17 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 16 44 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 17 19 1 0 0 0 0 17 48 1 0 0 0 0 17 49 1 0 0 0 0 18 50 1 0 0 0 0 18 51 1 0 0 0 0 19 22 1 0 0 0 0 19 52 1 0 0 0 0 19 53 1 0 0 0 0 20 21 1 0 0 0 0 21 25 1 0 0 0 0 21 54 1 0 0 0 0 22 24 1 0 0 0 0 22 56 1 0 0 0 0 22 57 1 0 0 0 0 23 26 1 0 0 0 0 23 59 1 0 0 0 0 23 60 1 0 0 0 0 24 61 1 0 0 0 0 24 62 1 0 0 0 0 25 63 1 0 0 0 0 25 64 1 0 0 0 0 25 65 1 0 0 0 0 26 30 2 0 0 0 0 27 28 1 0 0 0 0 28 66 1 0 0 0 0 28 67 1 0 0 0 0 29 68 1 0 0 0 0 29 69 1 0 0 0 0 29 70 1 0 0 0 0 30 31 1 0 0 0 0 30 71 1 0 0 0 0 31 32 1 0 0 0 0 32 33 1 0 0 0 0 32 73 1 0 0 0 0 32 74 1 0 0 0 0 33 34 1 0 0 0 0 33 75 1 0 0 0 0 33 76 1 0 0 0 0 34 77 1 0 0 0 0 34 78 1 0 0 0 0 34 79 1 0 0 0 0 M END $$$$