BB0J1V -OEChem-04012118582D 27 28 0 0 0 0 0 0 0999 V2000 7.2566 1.7809 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 5.6103 2.3190 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -2.1421 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 0.6241 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -0.5326 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.8373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.8373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 0.4179 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -1.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.3373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.8373 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2781 1.5747 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 2.7314 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9684 1.0376 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3751 0.5053 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8819 -1.3373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -2.7314 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.2827 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.9573 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.5273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3815 0.1627 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.1473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1566 2.5388 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7599 3.3207 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9780 2.9240 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 15 1 0 0 0 0 2 14 2 0 0 0 0 3 7 1 0 0 0 0 3 9 1 0 0 0 0 3 19 1 0 0 0 0 4 8 1 0 0 0 0 4 14 1 0 0 0 0 4 23 1 0 0 0 0 5 6 1 0 0 0 0 5 8 1 0 0 0 0 5 9 2 0 0 0 0 6 7 1 0 0 0 0 6 10 2 0 0 0 0 7 11 2 0 0 0 0 8 16 1 0 0 0 0 8 17 1 0 0 0 0 9 18 1 0 0 0 0 10 12 1 0 0 0 0 10 20 1 0 0 0 0 11 13 1 0 0 0 0 11 21 1 0 0 0 0 12 13 2 0 0 0 0 12 22 1 0 0 0 0 13 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 15 27 1 0 0 0 0 M END $$$$