E0GY0V -OEChem-05082103162D 41 41 0 0 0 0 0 0 0999 V2000 3.7320 -1.4050 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.4050 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 3.7320 1.5950 0.0000 Na 0 3 0 0 0 0 0 0 0 0 0 0 4.5981 1.0950 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 2.8660 -0.9050 0.0000 O 0 5 0 0 0 0 0 0 0 0 0 0 3.2320 -2.2710 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -0.5390 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 4.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.0950 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 1.0603 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 3.1297 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 -2.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 1.5742 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 2.6158 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -4.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 3.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.7150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0829 0.4404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0829 3.7496 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 -3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -1.5950 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 -3.2150 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 1.2621 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 2.9279 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8441 -4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -5.0250 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0841 -4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0611 4.4050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 5 1 0 0 0 0 1 6 2 0 0 0 0 1 7 2 0 0 0 0 1 17 1 0 0 0 0 4 18 1 0 0 0 0 8 29 1 0 0 0 0 8 41 1 0 0 0 0 9 29 2 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 19 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 20 2 0 0 0 0 13 15 1 0 0 0 0 13 21 2 0 0 0 0 14 18 2 0 0 0 0 15 16 2 0 0 0 0 15 30 1 0 0 0 0 16 18 1 0 0 0 0 16 29 1 0 0 0 0 17 19 2 0 0 0 0 17 23 1 0 0 0 0 19 24 1 0 0 0 0 20 26 1 0 0 0 0 20 31 1 0 0 0 0 21 27 1 0 0 0 0 21 32 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 22 28 1 0 0 0 0 23 33 1 0 0 0 0 24 25 2 0 0 0 0 24 34 1 0 0 0 0 25 35 1 0 0 0 0 26 27 2 0 0 0 0 26 36 1 0 0 0 0 27 37 1 0 0 0 0 28 38 1 0 0 0 0 28 39 1 0 0 0 0 28 40 1 0 0 0 0 M CHG 4 2 1 3 1 4 -1 5 -1 M END $$$$