L2TPQ8 -OEChem-05032300342D 81 84 0 1 0 0 0 0 0999 V2000 7.6138 0.1519 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 2.7973 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9280 -1.1304 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9244 1.1025 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 1.6405 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.0762 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.5708 0.5644 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 14.5098 -1.0499 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.6900 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.9889 0.4838 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6353 -0.0543 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.4667 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.7714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2816 -0.5924 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 3.7320 -1.7714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9710 -1.5429 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2601 -0.3861 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.2714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5458 3.0035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2566 1.8468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6388 -2.2872 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.2715 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5493 0.7706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.7714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2171 0.0263 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.7714 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.5243 3.2097 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3396 3.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7520 2.0250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1957 0.2325 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6173 -2.0810 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3282 -3.2377 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.8635 -0.5118 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2852 -2.8253 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9960 -3.9820 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.9745 -3.7758 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.5528 -1.4623 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8420 -0.3056 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.2207 -2.2066 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 14.1992 -2.0004 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5534 1.1515 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 1.1035 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 0.5712 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1089 -0.3819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8665 -0.6295 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4742 -0.0030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8640 2.1020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -1.2714 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4240 -1.2509 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5884 -2.0308 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -2.6655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.3486 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.8914 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.0757 1.0982 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3180 1.3458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1567 1.0258 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6908 -0.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4484 -0.5490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.4614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.0814 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6521 2.6030 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1310 3.3376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3964 3.8164 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9462 4.1099 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2117 4.5887 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7329 3.8542 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1453 1.8971 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8798 1.4183 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3587 2.1528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.7220 0.5602 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9644 0.8078 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8099 -1.4916 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7215 -3.3656 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8918 -2.6974 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.8034 -4.5713 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3886 -4.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9462 -1.5902 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0346 0.2838 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0281 -2.7959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.6132 -2.4619 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 14 1 0 0 0 0 2 20 1 0 0 0 0 2 21 1 0 0 0 0 3 18 2 0 0 0 0 4 21 2 0 0 0 0 9 5 1 6 0 0 0 5 21 1 0 0 0 0 5 48 1 0 0 0 0 6 15 1 0 0 0 0 6 16 1 0 0 0 0 6 52 1 0 0 0 0 7 18 1 0 0 0 0 7 24 1 0 0 0 0 7 57 1 0 0 0 0 8 39 1 0 0 0 0 8 41 2 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 42 1 0 0 0 0 10 12 1 0 0 0 0 10 43 1 0 0 0 0 10 44 1 0 0 0 0 11 45 1 0 0 0 0 11 46 1 0 0 0 0 12 13 1 0 0 0 0 12 16 2 0 0 0 0 13 15 1 0 0 0 0 13 19 2 0 0 0 0 14 17 1 0 0 0 0 14 18 1 1 0 0 0 14 47 1 0 0 0 0 15 23 2 0 0 0 0 16 49 1 0 0 0 0 17 22 1 0 0 0 0 17 50 1 0 0 0 0 17 51 1 0 0 0 0 19 25 1 0 0 0 0 19 53 1 0 0 0 0 20 28 1 0 0 0 0 20 29 1 0 0 0 0 20 30 1 0 0 0 0 22 32 2 0 0 0 0 22 33 1 0 0 0 0 23 27 1 0 0 0 0 23 54 1 0 0 0 0 24 26 1 0 0 0 0 24 55 1 0 0 0 0 24 56 1 0 0 0 0 25 27 2 0 0 0 0 25 60 1 0 0 0 0 26 31 1 0 0 0 0 26 58 1 0 0 0 0 26 59 1 0 0 0 0 27 61 1 0 0 0 0 28 62 1 0 0 0 0 28 63 1 0 0 0 0 28 64 1 0 0 0 0 29 65 1 0 0 0 0 29 66 1 0 0 0 0 29 67 1 0 0 0 0 30 68 1 0 0 0 0 30 69 1 0 0 0 0 30 70 1 0 0 0 0 31 34 1 0 0 0 0 31 71 1 0 0 0 0 31 72 1 0 0 0 0 32 35 1 0 0 0 0 32 73 1 0 0 0 0 33 36 2 0 0 0 0 33 74 1 0 0 0 0 34 38 1 0 0 0 0 34 39 2 0 0 0 0 35 37 2 0 0 0 0 35 75 1 0 0 0 0 36 37 1 0 0 0 0 36 76 1 0 0 0 0 37 77 1 0 0 0 0 38 40 2 0 0 0 0 38 78 1 0 0 0 0 39 79 1 0 0 0 0 40 41 1 0 0 0 0 40 80 1 0 0 0 0 41 81 1 0 0 0 0 M END $$$$