L2O1FS -OEChem-05032300302D 43 45 0 0 0 0 0 0 0999 V2000 12.2841 -0.1228 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.2918 1.9047 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.6592 2.2654 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 5.6525 0.5373 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.6860 -1.6228 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.4180 1.3772 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.7841 -0.9888 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 11.7841 0.7432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1693 0.0232 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1559 -0.6469 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 10.5520 -0.1228 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6860 1.3772 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4180 -0.6228 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.0778 -1.8535 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9949 -1.7000 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8200 -0.1228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8200 0.8772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0200 -0.1436 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0200 0.8980 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9260 -0.6575 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9260 1.4119 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6860 -0.6228 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5520 0.8772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1559 1.4014 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2408 -0.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0552 -1.6419 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5745 -0.9894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.1501 0.3772 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5796 -0.8888 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.5993 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9332 -1.2774 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9332 2.0318 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.6860 1.9972 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4180 -1.2428 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1095 0.3622 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5175 -2.0549 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4601 -0.1597 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.6870 0.6872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8401 0.9141 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2493 -2.2654 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0624 -0.9825 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3832 -1.5369 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9376 -2.2162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 7 2 0 0 0 0 1 8 2 0 0 0 0 1 13 1 0 0 0 0 1 28 1 0 0 0 0 2 24 1 0 0 0 0 3 24 1 0 0 0 0 4 24 1 0 0 0 0 5 22 2 0 0 0 0 6 23 2 0 0 0 0 9 29 2 0 0 0 0 10 18 1 0 0 0 0 10 25 1 0 0 0 0 10 26 1 0 0 0 0 11 13 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 12 17 1 0 0 0 0 12 23 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 14 26 2 0 0 0 0 14 27 1 0 0 0 0 15 29 1 0 0 0 0 15 30 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 16 20 2 0 0 0 0 16 22 1 0 0 0 0 17 21 2 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 24 1 0 0 0 0 20 31 1 0 0 0 0 21 32 1 0 0 0 0 25 27 2 0 0 0 0 25 35 1 0 0 0 0 26 36 1 0 0 0 0 27 29 1 0 0 0 0 28 37 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 30 41 1 0 0 0 0 30 42 1 0 0 0 0 30 43 1 0 0 0 0 M END $$$$