B85ZNS -OEChem-04042106013D 26 25 0 1 0 0 0 0 0999 V2000 -2.0244 -0.5926 0.1420 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.3568 -0.7273 -0.7667 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0957 -1.7922 -0.4191 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2603 -0.6257 1.6236 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1402 0.1670 -0.3402 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1497 1.9129 -0.0159 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.2209 0.8830 -0.4724 C 0 0 1 0 0 0 0 0 0 0 0 0 0.1663 1.1597 0.1031 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4655 0.4750 0.1770 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4727 -0.5735 -0.2884 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8632 -0.2862 0.2568 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1873 0.8738 -1.5675 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1140 1.1484 1.1992 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4930 2.1607 -0.2069 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1645 0.1402 -1.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7887 1.4652 -0.1668 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4452 0.4905 1.2735 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1583 -1.5707 0.0432 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5161 -0.5953 -1.3841 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0518 1.7875 -0.4741 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8132 2.8309 -0.3042 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2237 0.6902 -0.0824 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8647 -0.2922 1.3515 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 -1.0475 -0.0878 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9814 -1.4617 -0.5858 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3169 -2.7165 -0.1764 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 3 1 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 2 25 1 0 0 0 0 3 26 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 15 1 0 0 0 0 6 7 1 0 0 0 0 6 20 1 0 0 0 0 6 21 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 13 1 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 9 16 1 0 0 0 0 9 17 1 0 0 0 0 10 11 1 0 0 0 0 10 18 1 0 0 0 0 10 19 1 0 0 0 0 11 22 1 0 0 0 0 11 23 1 0 0 0 0 11 24 1 0 0 0 0 M END $$$$