B1I4TE -OEChem-04012113072D 33 36 0 1 0 0 0 0 0999 V2000 5.3958 2.7680 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3958 -0.2320 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.9989 -0.3991 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 1.2680 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5836 -0.0368 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5836 1.5727 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.6051 -1.2039 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 6.5938 -1.3069 0.0000 C 0 0 1 0 0 0 0 0 0 0 0 0 5.2062 -2.1080 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7976 -2.2739 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9418 -2.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 0.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5298 0.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5298 1.2680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3958 1.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1279 1.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0000 0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.7680 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7594 -1.1176 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4390 -1.3969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6684 -1.7996 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8430 -2.6104 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0494 -2.8404 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3874 -2.0830 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4815 -3.1834 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3065 -3.2693 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3910 2.1620 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.4379 1.2310 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6648 2.0780 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8179 2.3049 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 1.3880 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3800 0.7680 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 15 2 0 0 0 0 2 7 1 0 0 0 0 2 12 1 0 0 0 0 2 13 1 0 0 0 0 3 8 1 0 0 0 0 3 12 2 0 0 0 0 4 12 1 0 0 0 0 4 15 1 0 0 0 0 4 16 1 0 0 0 0 5 13 1 0 0 0 0 5 17 2 0 0 0 0 6 14 1 0 0 0 0 6 17 1 0 0 0 0 6 27 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 1 0 0 0 8 10 1 0 0 0 0 8 20 1 1 0 0 0 9 11 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 10 11 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 25 1 0 0 0 0 11 26 1 0 0 0 0 13 14 2 0 0 0 0 14 15 1 0 0 0 0 16 28 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 17 18 1 0 0 0 0 18 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 M END $$$$