BA27UE -OEChem-04012114522D 29 31 0 0 0 0 0 0 0999 V2000 4.6660 -1.3533 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 6.4144 1.6813 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 -1.3775 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 9.0602 1.1742 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.6660 0.6467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 0.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 0.1467 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5321 -0.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.8000 -0.8533 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 0.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4260 -1.3880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.3321 -0.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 0.6813 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9061 -1.3880 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 0.1675 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -0.8741 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1962 0.6708 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0646 1.1216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2675 1.1216 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4188 -2.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 1.3013 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9132 -2.0079 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 0.4796 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4643 -1.1862 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9478 1.9975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 1.9850 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1938 -1.9975 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7343 -1.0695 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 8 1 0 0 0 0 1 9 1 0 0 0 0 2 10 1 0 0 0 0 2 26 1 0 0 0 0 2 27 1 0 0 0 0 3 13 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 4 18 3 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 19 1 0 0 0 0 5 20 1 0 0 0 0 6 8 2 0 0 0 0 6 10 1 0 0 0 0 7 9 1 0 0 0 0 7 14 2 0 0 0 0 8 11 1 0 0 0 0 9 15 2 0 0 0 0 10 12 2 0 0 0 0 11 13 2 0 0 0 0 11 21 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 14 16 1 0 0 0 0 14 22 1 0 0 0 0 15 17 1 0 0 0 0 15 23 1 0 0 0 0 16 17 2 0 0 0 0 16 24 1 0 0 0 0 17 25 1 0 0 0 0 M END $$$$