L3ITE4 -OEChem-05022323432D 49 52 0 0 0 0 0 0 0999 V2000 4.4487 2.1555 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.1724 -0.6992 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 2.1555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6691 1.0622 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.6555 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8590 0.8507 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.0134 -1.9863 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.3191 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9128 1.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5827 0.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 1.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4426 1.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8590 2.4602 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4782 -0.3391 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 2.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1808 2.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 1.1555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.4426 1.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2213 -1.0082 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5000 -0.5470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4612 2.0404 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9426 2.5215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.9426 0.7894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7565 -2.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0623 -2.2954 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9426 2.5215 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9426 0.7894 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4426 1.6555 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 0.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0516 3.0495 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0468 3.2755 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6438 2.4655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3147 0.0355 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2478 -1.1134 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0677 2.1692 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3323 2.6468 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8548 1.9114 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6326 3.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.6326 0.2525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3417 -3.1162 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2173 -3.0703 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1714 -2.1947 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8707 -1.7057 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4727 -2.4869 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2539 -2.8850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2526 3.0584 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2526 0.2525 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0626 1.6555 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 18 2 0 0 0 0 2 20 2 0 0 0 0 3 9 1 0 0 0 0 3 14 1 0 0 0 0 3 16 1 0 0 0 0 4 8 1 0 0 0 0 4 10 1 0 0 0 0 4 22 1 0 0 0 0 5 11 1 0 0 0 0 5 18 1 0 0 0 0 5 34 1 0 0 0 0 6 9 2 0 0 0 0 6 12 1 0 0 0 0 7 20 1 0 0 0 0 7 25 1 0 0 0 0 7 26 1 0 0 0 0 8 21 2 0 0 0 0 9 13 1 0 0 0 0 10 15 2 0 0 0 0 10 18 1 0 0 0 0 11 13 2 0 0 0 0 11 17 1 0 0 0 0 12 14 2 0 0 0 0 12 19 1 0 0 0 0 13 30 1 0 0 0 0 14 31 1 0 0 0 0 15 20 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 32 1 0 0 0 0 17 33 1 0 0 0 0 19 23 2 0 0 0 0 19 24 1 0 0 0 0 21 35 1 0 0 0 0 22 36 1 0 0 0 0 22 37 1 0 0 0 0 22 38 1 0 0 0 0 23 27 1 0 0 0 0 23 39 1 0 0 0 0 24 28 2 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 26 44 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 29 2 0 0 0 0 27 47 1 0 0 0 0 28 29 1 0 0 0 0 28 48 1 0 0 0 0 29 49 1 0 0 0 0 M END $$$$