L2MB7I -OEChem-05022322013D 30 31 0 0 0 0 0 0 0999 V2000 -3.9950 -0.1073 0.0004 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.4636 -0.6698 -1.2583 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.4656 -0.6641 1.2608 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.2943 1.5749 -0.0020 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5402 -0.1788 -0.0004 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9868 -0.2026 -0.0008 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7265 0.9801 -0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2491 -0.1348 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1569 -0.1662 1.2078 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1575 -0.1694 -1.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5515 -0.1442 1.2082 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5521 -0.1474 -1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6411 -1.4344 0.0003 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1206 0.9306 0.0006 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0604 2.3186 -0.0031 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0351 -1.4838 0.0014 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7749 -0.3013 0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3718 -0.1715 2.1581 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3706 -0.1772 -2.1588 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0737 -0.1280 2.1606 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0747 -0.1337 -2.1602 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0812 -2.3669 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7134 1.8415 0.0005 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4432 2.4436 -0.8988 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4399 2.4455 0.8899 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7914 3.1349 -0.0026 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5446 -2.4429 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8603 -0.3400 0.0024 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6681 1.9915 -0.8635 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 1.9939 0.8584 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 2 0 0 0 0 1 3 2 0 0 0 0 1 4 1 0 0 0 0 1 8 1 0 0 0 0 4 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 1 0 0 0 0 5 9 2 0 0 0 0 5 10 1 0 0 0 0 6 7 1 0 0 0 0 6 13 2 0 0 0 0 7 14 2 0 0 0 0 7 15 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 11 1 0 0 0 0 9 18 1 0 0 0 0 10 12 2 0 0 0 0 10 19 1 0 0 0 0 11 20 1 0 0 0 0 12 21 1 0 0 0 0 13 16 1 0 0 0 0 13 22 1 0 0 0 0 14 17 1 0 0 0 0 14 23 1 0 0 0 0 15 24 1 0 0 0 0 15 25 1 0 0 0 0 15 26 1 0 0 0 0 16 17 2 0 0 0 0 16 27 1 0 0 0 0 17 28 1 0 0 0 0 M END $$$$