L58DOR -OEChem-05022322413D 39 41 0 0 0 0 0 0 0999 V2000 -1.5949 0.9092 -1.3746 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6375 3.3483 -1.4425 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9823 0.4502 1.8429 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0676 -3.1648 -0.7919 O 0 5 0 0 0 0 0 0 0 0 0 0 -1.7046 -1.6851 -1.6704 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6734 -1.9843 -0.9346 N 0 3 0 0 0 0 0 0 0 0 0 0 2.2416 0.7215 0.3516 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9382 1.3956 -0.9896 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0666 -0.1636 0.7778 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5000 1.6822 -0.1528 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6989 2.2558 -0.8747 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1885 0.6680 0.9252 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5403 -0.0610 0.3013 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5289 -1.4015 -0.0789 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7406 0.5631 0.6350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9664 0.3919 -0.3476 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7229 -2.1211 -0.1253 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9346 -0.1566 0.5883 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9257 -1.4987 0.2081 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3513 -0.9450 -0.2356 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6607 1.3768 0.3564 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4280 -1.2960 0.5788 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7373 1.0257 1.1709 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.1209 -0.3107 1.2820 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3472 1.5059 1.1161 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7785 0.6599 -1.7863 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7749 2.0374 -1.2903 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2755 -0.6460 1.7401 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8277 -0.9419 0.0456 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9974 2.5294 0.3335 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6227 -1.9203 -0.3709 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7607 1.6085 0.9305 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7174 -3.1645 -0.4269 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8714 0.3282 0.8471 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8556 -2.0585 0.1704 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3915 2.4274 0.2803 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7611 -2.3242 0.6949 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2786 1.7930 1.7166 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9596 -0.5833 1.9159 H 0 0 0 0 0 0 0 0 0 0 0 0 1 10 1 0 0 0 0 1 16 1 0 0 0 0 2 11 2 0 0 0 0 3 12 2 0 0 0 0 4 6 1 0 0 0 0 5 6 2 0 0 0 0 6 20 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 13 1 0 0 0 0 7 25 1 0 0 0 0 8 11 1 0 0 0 0 8 26 1 0 0 0 0 8 27 1 0 0 0 0 9 12 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 14 17 1 0 0 0 0 14 31 1 0 0 0 0 15 18 2 0 0 0 0 15 32 1 0 0 0 0 16 20 1 0 0 0 0 16 21 2 0 0 0 0 17 19 2 0 0 0 0 17 33 1 0 0 0 0 18 19 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 20 22 2 0 0 0 0 21 23 1 0 0 0 0 21 36 1 0 0 0 0 22 24 1 0 0 0 0 22 37 1 0 0 0 0 23 24 2 0 0 0 0 23 38 1 0 0 0 0 24 39 1 0 0 0 0 M CHG 2 4 -1 6 1 M END $$$$