BEU0I1 -OEChem-04022102242D 43 47 0 0 0 0 0 0 0999 V2000 7.7491 0.1503 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.9126 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3512 -2.1721 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 12.1971 0.4376 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.4595 0.9819 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.3556 -2.4245 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7588 -0.5445 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 12.4559 1.4035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.0853 2.7521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.8549 0.8947 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2193 2.2521 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 13.5960 -0.0713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4824 0.7852 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.8244 -0.1545 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1672 -0.9626 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1400 -0.7897 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7838 0.1892 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3224 -1.4250 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4645 -0.8453 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5248 -1.1873 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8191 -0.8865 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6454 -1.8713 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0530 -0.2437 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7057 -2.2134 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1133 -0.5858 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9397 -1.5706 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.9116 1.8239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.6670 2.9666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 11.8221 3.3135 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.4488 0.7169 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.0498 1.4832 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.9146 2.7921 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6764 1.9527 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.4011 -0.6598 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 14.1900 -0.2490 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3860 -1.5427 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9025 -2.7165 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8293 -2.7521 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8664 0.0661 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1204 -2.2699 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1607 0.3668 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5981 -2.8239 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6384 -0.1872 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 17 1 0 0 0 0 1 19 1 0 0 0 0 2 26 1 0 0 0 0 3 20 2 0 0 0 0 4 11 1 0 0 0 0 4 12 1 0 0 0 0 4 14 1 0 0 0 0 5 13 1 0 0 0 0 5 17 2 0 0 0 0 6 18 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 20 1 0 0 0 0 7 21 1 0 0 0 0 7 39 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 13 1 0 0 0 0 8 27 1 0 0 0 0 9 11 1 0 0 0 0 9 28 1 0 0 0 0 9 29 1 0 0 0 0 10 12 1 0 0 0 0 10 30 1 0 0 0 0 10 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 34 1 0 0 0 0 12 35 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 36 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 18 19 2 0 0 0 0 19 20 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 22 24 1 0 0 0 0 22 40 1 0 0 0 0 23 25 2 0 0 0 0 23 41 1 0 0 0 0 24 26 2 0 0 0 0 24 42 1 0 0 0 0 25 26 1 0 0 0 0 25 43 1 0 0 0 0 M END $$$$