D0SH1L -OEChem-10101305022D 46 49 0 0 0 0 0 0 0999 V2000 4.5981 0.9827 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -0.5173 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 0.9827 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 3.5035 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -2.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 1.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -2.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.1962 3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 2.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 0.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 -3.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.5173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 3.9827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 1.9480 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 3.4827 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0901 4.0173 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9962 2.4618 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -0.3973 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -0.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -2.2073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 0.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -2.2073 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8671 0.6727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 2.1727 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1951 -3.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 1.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0010 -3.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.8273 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3301 4.6027 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0829 1.3280 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 0.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 -4.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9272 3.7927 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0829 4.6373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5319 2.1498 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 13 2 0 0 0 0 2 5 1 0 0 0 0 2 13 1 0 0 0 0 2 29 1 0 0 0 0 3 8 1 0 0 0 0 3 13 1 0 0 0 0 3 34 1 0 0 0 0 4 26 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 28 1 0 0 0 0 6 9 2 0 0 0 0 6 11 1 0 0 0 0 7 10 2 0 0 0 0 7 12 1 0 0 0 0 8 14 1 0 0 0 0 8 16 2 0 0 0 0 9 18 1 0 0 0 0 9 30 1 0 0 0 0 10 17 1 0 0 0 0 10 31 1 0 0 0 0 11 19 2 0 0 0 0 11 32 1 0 0 0 0 12 20 2 0 0 0 0 12 33 1 0 0 0 0 14 15 2 0 0 0 0 14 22 1 0 0 0 0 15 21 1 0 0 0 0 15 26 1 0 0 0 0 16 25 1 0 0 0 0 16 35 1 0 0 0 0 17 24 2 0 0 0 0 17 37 1 0 0 0 0 18 23 2 0 0 0 0 18 36 1 0 0 0 0 19 23 1 0 0 0 0 19 38 1 0 0 0 0 20 24 1 0 0 0 0 20 39 1 0 0 0 0 21 25 2 0 0 0 0 21 40 1 0 0 0 0 22 27 2 0 0 0 0 22 41 1 0 0 0 0 23 43 1 0 0 0 0 24 42 1 0 0 0 0 25 44 1 0 0 0 0 26 45 1 0 0 0 0 27 46 1 0 0 0 0 M END $$$$