54678486 OpenBabel04211813443D 39 41 0 0 0 0 0 0 0 0999 V2000 7.1323 3.0551 0.2248 O 0 0 0 0 0 0 0 0 0 0 0 0 6.8808 -1.1718 -0.3336 O 0 0 0 0 0 0 0 0 0 0 0 0 4.9303 3.2045 0.2269 O 0 0 0 0 0 0 0 0 0 0 0 0 2.5343 -1.9529 -0.8866 O 0 0 0 0 0 0 0 0 0 0 0 0 4.3141 0.1862 -0.2685 C 0 0 1 0 0 0 0 0 0 0 0 0 5.7540 0.9538 -0.0671 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2926 -1.1752 0.5531 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9633 1.0225 -0.0719 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9066 0.2321 -0.1203 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2283 0.9192 0.0303 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9033 2.4607 0.1379 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2455 -2.1855 0.0979 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 0.5628 0.7385 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6916 2.2750 -0.8095 C 0 0 0 0 0 0 0 0 0 0 0 0 8.2723 2.3553 0.1848 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3765 0.2339 0.0069 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7301 1.2725 0.9069 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5451 2.9370 -0.6355 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4399 2.9907 0.2932 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1407 -3.5105 0.7969 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5151 2.4117 0.2583 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6621 0.9181 0.1345 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6936 2.2403 0.2658 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3617 -0.1052 -1.3259 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2739 -1.6408 0.4616 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0993 -0.9359 1.5988 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1677 -0.3641 1.2873 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4367 2.6627 -1.5041 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3535 -0.8497 -0.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0386 0.8658 1.5641 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3763 3.8754 -1.1637 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4591 4.0750 0.4029 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8370 -3.5358 1.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3847 -4.3108 0.0982 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1241 -3.6480 1.1654 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4228 2.9508 0.3917 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5903 0.3467 0.1222 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7724 -1.5718 -0.3399 H 0 0 0 0 0 0 0 0 0 0 0 0 11.6473 2.7610 0.3522 H 0 0 0 0 0 0 0 0 0 0 0 0 1 11 1 0 0 0 0 1 15 1 0 0 0 0 2 9 1 0 0 0 0 2 38 1 0 0 0 0 3 11 2 0 0 0 0 4 12 2 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 8 1 0 0 0 0 5 24 1 6 0 0 0 6 9 2 0 0 0 0 6 11 1 0 0 0 0 7 12 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 13 2 0 0 0 0 8 14 1 0 0 0 0 9 10 1 0 0 0 0 10 15 1 0 0 0 0 10 16 2 0 0 0 0 12 20 1 0 0 0 0 13 17 1 0 0 0 0 13 27 1 0 0 0 0 14 18 2 0 0 0 0 14 28 1 0 0 0 0 15 19 2 0 0 0 0 16 22 1 0 0 0 0 16 29 1 0 0 0 0 17 21 2 0 0 0 0 17 30 1 0 0 0 0 18 21 1 0 0 0 0 18 31 1 0 0 0 0 19 23 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 21 36 1 0 0 0 0 22 23 2 0 0 0 0 22 37 1 0 0 0 0 23 39 1 0 0 0 0 M END