BP98VD -OEChem-04022108113D 29 28 0 0 0 0 0 0 0999 V2000 0.1061 0.0506 1.3318 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.0108 -1.4973 -0.2741 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.8893 0.6152 0.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9838 -0.0117 -0.3881 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7898 0.8249 -0.6642 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7208 -0.0537 0.3385 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5778 0.4120 -0.5572 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2404 0.3993 0.1619 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1572 0.8988 -0.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0829 -0.4639 0.4536 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9117 -0.4023 -0.4479 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4013 -0.4312 -0.3007 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3542 -0.3407 0.0053 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5162 -1.0759 0.6806 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7722 0.5867 1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4982 -0.2374 -1.4379 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7634 1.4349 -0.9084 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1650 0.9378 -0.7126 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1697 1.1572 0.8571 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6345 1.7217 -0.7512 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1698 0.1711 1.3433 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9016 -1.4910 0.7916 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5885 1.0864 -1.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4220 -1.2214 0.0913 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9002 -0.6401 -1.5181 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3672 -1.0777 -1.1842 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6448 0.5850 -0.6288 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2144 -0.7817 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9480 -1.4641 0.0138 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 2 0 0 0 0 2 13 1 0 0 0 0 2 29 1 0 0 0 0 3 13 2 0 0 0 0 4 6 1 0 0 0 0 4 10 1 0 0 0 0 4 18 1 0 0 0 0 5 8 1 0 0 0 0 5 9 1 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 14 1 0 0 0 0 6 15 1 0 0 0 0 7 8 1 0 0 0 0 7 16 1 0 0 0 0 7 17 1 0 0 0 0 9 11 1 0 0 0 0 9 19 1 0 0 0 0 9 20 1 0 0 0 0 10 12 1 0 0 0 0 10 21 1 0 0 0 0 10 22 1 0 0 0 0 11 13 1 0 0 0 0 11 24 1 0 0 0 0 11 25 1 0 0 0 0 12 26 1 0 0 0 0 12 27 1 0 0 0 0 12 28 1 0 0 0 0 M END $$$$