D07NKJ -OEChem-05142003402D 39 42 0 0 0 0 0 0 0999 V2000 6.9718 0.4163 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.2071 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 -0.7929 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 1.2071 0.0000 F 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 2.9050 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8069 -2.5950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.9409 -1.0950 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8069 1.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.8069 0.4050 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1671 1.8101 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4329 -0.1297 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 11.4329 1.9397 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 7.9409 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0749 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 -0.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 1.0731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0000 0.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 0.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 1.9050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.5390 1.4050 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6730 -1.0950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 1.0731 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0000 0.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -0.6590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5000 -0.6590 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.2071 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8069 -1.5950 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3390 0.3842 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.3390 1.4258 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.3394 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5424 2.3800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.8850 -1.6776 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.2835 -0.9873 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 1.6100 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8100 -1.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1900 -1.1959 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8747 0.0721 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8747 1.7379 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3439 -2.9050 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 14 1 0 0 0 0 1 17 1 0 0 0 0 2 26 1 0 0 0 0 3 26 1 0 0 0 0 4 26 1 0 0 0 0 5 19 2 0 0 0 0 6 27 1 0 0 0 0 6 39 1 0 0 0 0 7 27 2 0 0 0 0 8 9 1 0 0 0 0 8 13 1 0 0 0 0 8 19 1 0 0 0 0 9 15 2 0 0 0 0 10 14 2 0 0 0 0 10 16 1 0 0 0 0 11 18 2 0 0 0 0 11 28 1 0 0 0 0 12 20 2 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 15 18 1 0 0 0 0 15 21 1 0 0 0 0 16 17 2 0 0 0 0 16 22 1 0 0 0 0 17 24 1 0 0 0 0 18 20 1 0 0 0 0 19 20 1 0 0 0 0 21 27 1 0 0 0 0 21 32 1 0 0 0 0 21 33 1 0 0 0 0 22 23 2 0 0 0 0 22 34 1 0 0 0 0 23 25 1 0 0 0 0 23 26 1 0 0 0 0 24 25 2 0 0 0 0 24 35 1 0 0 0 0 25 36 1 0 0 0 0 28 29 2 0 0 0 0 28 37 1 0 0 0 0 29 38 1 0 0 0 0 M END $$$$