B9MJY2 -OEChem-04012116572D 37 39 0 0 0 0 0 0 0999 V2000 4.0767 0.1059 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3500 1.7614 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.9487 2.7795 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 2.9705 2.9874 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.4487 3.6455 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -0.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7676 1.0569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -1.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3554 1.8659 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7796 4.3887 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 3.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4586 0.1059 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7676 1.0569 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1337 -1.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4016 -1.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4432 3.7500 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -3.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1337 -2.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4016 -2.9819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 4.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -4.4819 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9085 4.9951 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8690 -0.0857 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4032 1.5585 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6706 -1.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8647 -1.6719 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5080 3.1334 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0598 3.8148 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3784 4.3666 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6706 -3.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8647 -3.2919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3100 5.0188 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 4.7919 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6900 3.9450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6476 -4.4819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2676 -5.1019 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8876 -4.4819 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 2 9 2 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 4 11 2 0 0 0 0 5 10 2 0 0 0 0 5 16 1 0 0 0 0 6 8 1 0 0 0 0 6 12 2 0 0 0 0 7 9 1 0 0 0 0 7 13 2 0 0 0 0 8 14 2 0 0 0 0 8 15 1 0 0 0 0 10 11 1 0 0 0 0 10 22 1 0 0 0 0 11 20 1 0 0 0 0 12 13 1 0 0 0 0 12 23 1 0 0 0 0 13 24 1 0 0 0 0 14 18 1 0 0 0 0 14 25 1 0 0 0 0 15 19 2 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 17 21 1 0 0 0 0 18 30 1 0 0 0 0 19 31 1 0 0 0 0 20 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 21 35 1 0 0 0 0 21 36 1 0 0 0 0 21 37 1 0 0 0 0 M END $$$$