LIG2O4 -OEChem-05022321232D 46 48 0 1 0 0 0 0 0999 V2000 4.7320 2.4330 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 8.9282 -1.2990 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 8.5622 -2.6651 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 7.5622 -0.9330 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.2990 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.2990 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.7990 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7320 0.7010 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2320 1.5670 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 -2.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6962 -3.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6962 -3.1651 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0622 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.7010 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 4.5981 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.4330 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8660 0.2010 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.7990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 3.2990 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 1.5670 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.1135 -2.9530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5885 -3.7756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8038 -3.7756 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2788 -2.9530 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.1790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0656 -2.7740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8626 -2.7740 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7571 1.9655 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7571 1.1685 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.4890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0420 2.9700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 0.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -0.1090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1760 -0.3360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3291 -2.1090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7690 3.6090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9220 3.8360 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6951 2.9890 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 2.1039 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5420 1.0300 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 20 1 0 0 0 0 1 26 1 0 0 0 0 2 13 1 0 0 0 0 3 13 1 0 0 0 0 4 13 1 0 0 0 0 5 22 1 0 0 0 0 6 23 1 0 0 0 0 7 10 1 0 0 0 0 7 14 1 0 0 0 0 7 31 1 0 0 0 0 8 15 1 0 0 0 0 8 26 2 0 0 0 0 9 26 1 0 0 0 0 9 45 1 0 0 0 0 9 46 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 13 1 0 0 0 0 11 12 1 0 0 0 0 11 27 1 0 0 0 0 11 28 1 0 0 0 0 12 29 1 0 0 0 0 12 30 1 0 0 0 0 14 16 1 0 0 0 0 14 32 1 0 0 0 0 14 33 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 15 21 1 1 0 0 0 16 19 2 0 0 0 0 16 22 1 0 0 0 0 17 20 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 36 1 0 0 0 0 20 25 1 1 0 0 0 20 37 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 21 40 1 0 0 0 0 22 24 2 0 0 0 0 23 24 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END $$$$