D05KUM -OEChem-10101305032D 39 42 0 0 0 0 0 0 0999 V2000 3.7230 -2.6567 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5448 0.5087 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6770 2.3106 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9786 -0.3923 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4786 -2.5829 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1081 1.3349 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5476 0.5834 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6742 2.2359 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1137 1.4844 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9786 -0.3923 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3552 -1.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5777 -2.1490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6021 -1.1741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3648 -1.0876 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3796 -2.1490 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9749 -2.0020 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5926 -0.8518 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1322 -2.8692 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.2245 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3616 -1.5544 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1298 -2.5699 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5519 0.9020 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6115 1.6968 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9507 0.4155 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6093 -0.0335 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2710 2.4038 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6125 2.8528 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6698 1.9173 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6103 1.1225 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4080 2.8692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2477 0.1663 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0459 -0.5559 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7236 -0.2458 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9872 -3.4720 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8620 -1.6200 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3955 -2.3624 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1380 -2.8290 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9534 -1.3694 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5827 -2.9934 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 12 1 0 0 0 0 1 16 1 0 0 0 0 2 6 1 0 0 0 0 2 7 1 0 0 0 0 2 10 1 0 0 0 0 3 8 1 0 0 0 0 3 9 1 0 0 0 0 3 30 1 0 0 0 0 4 10 1 0 0 0 0 4 13 1 0 0 0 0 4 31 1 0 0 0 0 5 12 2 0 0 0 0 5 15 1 0 0 0 0 6 8 1 0 0 0 0 6 22 1 0 0 0 0 6 23 1 0 0 0 0 7 9 1 0 0 0 0 7 24 1 0 0 0 0 7 25 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 2 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 13 15 1 0 0 0 0 13 17 2 0 0 0 0 14 16 2 0 0 0 0 14 32 1 0 0 0 0 15 18 2 0 0 0 0 16 19 1 0 0 0 0 17 20 1 0 0 0 0 17 33 1 0 0 0 0 18 21 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 2 0 0 0 0 20 38 1 0 0 0 0 21 39 1 0 0 0 0 M END $$$$