B79EYC -OEChem-04022119003D 40 42 0 1 0 0 0 0 0999 V2000 -2.6868 2.7780 -0.3717 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.5709 2.4859 -1.1676 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.8259 -0.1646 0.1745 N 0 0 2 0 0 0 0 0 0 0 0 0 1.4780 -1.2666 -1.1534 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3633 1.1460 0.6866 C 0 0 1 0 0 0 0 0 0 0 0 0 0.0803 1.0887 1.2528 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9906 -0.7305 -0.9056 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 0.2317 0.4122 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4485 -0.6019 -0.5541 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2413 -0.1793 -0.1827 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3776 0.0655 0.4088 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9017 -1.5419 0.0887 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6724 -0.8782 -0.5825 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4640 2.1934 -0.3865 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3712 -1.5780 -0.3389 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7904 -1.8824 1.5773 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4385 0.6223 1.1506 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9801 -1.2880 -0.8667 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7504 0.2201 0.8758 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0147 -0.7204 -0.1175 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9969 1.4639 1.5262 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0504 0.6545 2.2606 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 2.0959 1.3398 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1713 -0.2191 -1.8594 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2281 -1.7912 -1.0441 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3932 0.1150 -1.2294 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7929 0.5558 0.4191 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3815 -2.3212 -0.4814 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3856 -1.9386 -1.9029 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 -1.3612 -1.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8077 -2.5656 -0.1563 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9623 -0.8374 0.2105 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7469 -1.9817 1.8930 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2831 -2.8373 1.7916 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2643 -1.1153 2.1995 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2481 1.3566 1.9282 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1880 -2.0206 -1.6394 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5717 0.6472 1.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0414 -1.0184 -0.3141 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7728 3.4652 -1.0664 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 40 1 0 0 0 0 2 14 2 0 0 0 0 3 5 1 0 0 0 0 3 7 1 0 0 0 0 3 10 1 0 0 0 0 4 9 1 0 0 0 0 4 13 1 0 0 0 0 4 29 1 0 0 0 0 5 6 1 0 0 0 0 5 14 1 0 0 0 0 5 21 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 9 2 0 0 0 0 8 11 1 0 0 0 0 10 12 1 0 0 0 0 10 26 1 0 0 0 0 10 27 1 0 0 0 0 11 13 1 0 0 0 0 11 17 2 0 0 0 0 12 15 1 0 0 0 0 12 16 1 0 0 0 0 12 28 1 0 0 0 0 13 18 2 0 0 0 0 15 30 1 0 0 0 0 15 31 1 0 0 0 0 15 32 1 0 0 0 0 16 33 1 0 0 0 0 16 34 1 0 0 0 0 16 35 1 0 0 0 0 17 19 1 0 0 0 0 17 36 1 0 0 0 0 18 20 1 0 0 0 0 18 37 1 0 0 0 0 19 20 2 0 0 0 0 19 38 1 0 0 0 0 20 39 1 0 0 0 0 M END $$$$