D00PVE -OEChem-09301911323D 38 41 0 0 0 0 0 0 0999 V2000 -2.8325 -1.5003 1.2411 S 0 0 0 0 0 0 0 0 0 0 0 0 4.3501 -1.3918 -1.3887 O 0 0 0 0 0 0 0 0 0 0 0 0 5.0566 0.4999 0.6675 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8914 1.4451 0.6971 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.6175 -0.9462 1.8191 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.9526 -1.8489 2.1011 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6148 2.4502 2.0550 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2367 -0.1530 -0.9187 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4378 0.8830 0.5009 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0904 -0.0003 -0.5172 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5707 0.4963 -0.6291 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4239 -0.3998 0.0146 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4241 -0.6119 -0.7465 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7648 0.2964 0.2572 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1242 0.5602 -0.3063 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0926 -0.7490 -1.1431 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7707 1.0370 0.8959 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5951 -1.4296 -0.6859 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0025 -0.0314 -0.2642 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3716 1.6589 1.1533 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0724 1.3605 -1.6023 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7789 -0.4317 -0.3148 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3619 -2.9546 0.3341 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4275 1.3285 -1.9318 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2808 0.4324 -1.2881 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8323 -1.4488 -1.9342 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0431 1.7327 1.6852 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3445 -1.8572 -1.3592 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4896 -2.0977 0.1778 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9795 -0.0524 0.2286 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0669 0.6474 -1.1236 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4172 2.0633 -2.1108 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4633 -1.1257 0.1649 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9853 -3.6907 1.0476 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2394 -3.3516 -0.1797 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5786 -2.6968 -0.3803 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8181 2.0011 -2.6899 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3354 0.4064 -1.5463 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 2 0 0 0 0 1 6 2 0 0 0 0 1 12 1 0 0 0 0 1 23 1 0 0 0 0 2 13 1 0 0 0 0 2 18 1 0 0 0 0 3 14 1 0 0 0 0 3 19 1 0 0 0 0 4 15 1 0 0 0 0 4 20 1 0 0 0 0 7 20 2 0 0 0 0 8 10 1 0 0 0 0 8 15 2 0 0 0 0 9 10 1 0 0 0 0 9 17 2 0 0 0 0 9 20 1 0 0 0 0 10 16 2 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 21 2 0 0 0 0 12 22 2 0 0 0 0 13 14 2 0 0 0 0 13 16 1 0 0 0 0 14 17 1 0 0 0 0 16 26 1 0 0 0 0 17 27 1 0 0 0 0 18 19 1 0 0 0 0 18 28 1 0 0 0 0 18 29 1 0 0 0 0 19 30 1 0 0 0 0 19 31 1 0 0 0 0 21 24 1 0 0 0 0 21 32 1 0 0 0 0 22 25 1 0 0 0 0 22 33 1 0 0 0 0 23 34 1 0 0 0 0 23 35 1 0 0 0 0 23 36 1 0 0 0 0 24 25 2 0 0 0 0 24 37 1 0 0 0 0 25 38 1 0 0 0 0 M END $$$$