LE3C2B -OEChem-05022323382D 41 44 0 1 0 0 0 0 0999 V2000 7.8435 1.8425 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 3.8763 0.0166 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1551 1.7766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.7731 1.7766 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 3.3644 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6744 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8256 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 5.4641 -0.1744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4641 0.8256 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4422 1.0335 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.9641 2.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.6744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -0.6744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1854 0.3644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.6744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8490 1.9470 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2040 2.0856 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.6744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.1744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0514 0.8644 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1744 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -0.3644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -0.3644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1206 -0.2522 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5390 2.4840 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3956 2.6753 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6144 2.2772 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0124 1.4960 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.9844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.7944 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6178 0.6122 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4272 3.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5010 3.6744 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0544 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -3.4844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.8644 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.4844 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 16 1 0 0 0 0 1 20 1 0 0 0 0 2 9 2 0 0 0 0 3 9 1 0 0 0 0 3 11 1 0 0 0 0 3 17 1 0 0 0 0 4 7 1 0 0 0 0 4 11 2 0 0 0 0 5 11 1 0 0 0 0 5 36 1 0 0 0 0 5 37 1 0 0 0 0 6 23 1 0 0 0 0 6 25 2 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 10 1 1 0 0 0 8 12 1 0 0 0 0 8 13 2 0 0 0 0 10 14 1 0 0 0 0 10 16 2 0 0 0 0 12 15 2 0 0 0 0 12 26 1 0 0 0 0 13 18 1 0 0 0 0 13 27 1 0 0 0 0 14 20 2 0 0 0 0 14 28 1 0 0 0 0 15 19 1 0 0 0 0 15 21 1 0 0 0 0 16 29 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 17 32 1 0 0 0 0 18 19 2 0 0 0 0 18 33 1 0 0 0 0 19 34 1 0 0 0 0 20 35 1 0 0 0 0 21 22 1 0 0 0 0 21 23 2 0 0 0 0 22 24 2 0 0 0 0 22 38 1 0 0 0 0 23 39 1 0 0 0 0 24 25 1 0 0 0 0 24 40 1 0 0 0 0 25 41 1 0 0 0 0 M END $$$$