D00MLE -OEChem-10101305022D 38 41 0 0 0 0 0 0 0999 V2000 10.6648 0.4890 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 1.2938 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.0812 -0.3157 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 1.4890 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 0.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6648 0.4890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 -0.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.6648 0.4890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 1.4890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.5110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 0.9890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1648 -0.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1648 1.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4030 -0.0110 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.6648 0.4890 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1648 -0.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1648 1.3551 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1648 -0.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6648 -1.2430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1648 -0.3770 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 11.1648 -2.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6648 -1.2430 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 12.1648 -2.1090 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2738 1.8831 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 2.1090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -1.1310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8548 -0.9139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8548 1.8920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.3210 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4748 -0.9139 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4748 1.8920 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.1790 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5369 2.1090 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0448 -1.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4748 0.1599 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8548 -2.6460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2848 -1.2430 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 12.4748 -2.6460 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 1 0 0 0 0 1 18 1 0 0 0 0 2 5 1 0 0 0 0 2 6 1 0 0 0 0 2 24 1 0 0 0 0 3 6 2 0 0 0 0 3 7 1 0 0 0 0 4 11 1 0 0 0 0 4 32 1 0 0 0 0 4 33 1 0 0 0 0 5 7 2 0 0 0 0 5 9 1 0 0 0 0 6 8 1 0 0 0 0 7 10 1 0 0 0 0 8 12 2 0 0 0 0 8 13 1 0 0 0 0 9 11 2 0 0 0 0 9 25 1 0 0 0 0 10 14 2 0 0 0 0 10 26 1 0 0 0 0 11 14 1 0 0 0 0 12 16 1 0 0 0 0 12 27 1 0 0 0 0 13 17 2 0 0 0 0 13 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 16 30 1 0 0 0 0 17 31 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 19 21 1 0 0 0 0 19 34 1 0 0 0 0 20 22 2 0 0 0 0 20 35 1 0 0 0 0 21 23 2 0 0 0 0 21 36 1 0 0 0 0 22 23 1 0 0 0 0 22 37 1 0 0 0 0 23 38 1 0 0 0 0 M END $$$$