BV3YR6 -OEChem-04022111553D 40 42 0 1 0 0 0 0 0999 V2000 2.6514 -2.2012 0.3389 P 0 0 0 0 0 0 0 0 0 0 0 0 4.0785 -2.4042 -0.3608 O 0 0 0 0 0 0 0 0 0 0 0 0 1.7232 -3.3449 -0.2920 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -2.0355 1.8034 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0292 -0.7080 -0.5455 C 0 0 1 0 0 0 0 0 0 0 0 0 0.5612 -0.4815 -0.4116 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8544 0.5394 -0.2417 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1761 -0.0225 -1.5032 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0745 -0.7291 0.8049 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1849 -0.0590 -0.1614 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5492 0.1887 -1.3781 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4476 -0.5179 0.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6854 1.0814 -1.2223 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7777 1.1375 1.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6090 0.1608 -0.0316 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4397 2.2215 -0.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5319 2.2777 1.2932 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3630 2.8197 0.3128 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0882 1.4072 0.3715 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.5027 -0.8734 -0.3093 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4612 1.6195 0.4968 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8755 -0.6613 -0.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3548 0.5851 0.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2101 -0.9799 -1.5961 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3060 0.1767 -2.4567 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4585 -1.0691 1.6834 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1090 0.5472 -2.2387 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9273 -0.7121 1.8865 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7565 0.6268 -2.2066 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1475 0.7330 1.8012 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0870 2.6434 -1.7083 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4741 2.7424 2.2732 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6580 -3.1398 -0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8247 -4.2711 0.0141 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9507 3.7071 0.5289 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4053 2.2244 0.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1461 -1.8512 -0.6246 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.8344 2.5899 0.8106 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5716 -1.4666 -0.4002 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.4238 0.7502 0.3166 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 5 1 0 0 0 0 2 33 1 0 0 0 0 3 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 24 1 0 0 0 0 6 8 2 0 0 0 0 6 9 1 0 0 0 0 7 13 2 0 0 0 0 7 14 1 0 0 0 0 8 11 1 0 0 0 0 8 25 1 0 0 0 0 9 12 2 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 10 15 1 0 0 0 0 11 27 1 0 0 0 0 12 28 1 0 0 0 0 13 16 1 0 0 0 0 13 29 1 0 0 0 0 14 17 2 0 0 0 0 14 30 1 0 0 0 0 15 19 2 0 0 0 0 15 20 1 0 0 0 0 16 18 2 0 0 0 0 16 31 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 35 1 0 0 0 0 19 21 1 0 0 0 0 19 36 1 0 0 0 0 20 22 2 0 0 0 0 20 37 1 0 0 0 0 21 23 2 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 23 40 1 0 0 0 0 M END $$$$