B5IBM8 -OEChem-04012118132D 35 37 0 0 0 0 0 0 0999 V2000 6.2781 0.2520 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 6.2619 -2.6600 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 7.2286 -0.0587 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.3276 0.5626 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -3.4647 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.9889 -0.9048 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9674 -0.6985 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -3.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6783 -1.8553 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2619 -2.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.6600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5888 1.2025 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -3.1600 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2101 3.1035 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5673 1.4087 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9209 1.9468 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.8779 2.3592 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2316 2.8973 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5208 4.0541 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8709 -4.0541 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -1.0400 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -4.2800 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -1.8500 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -3.4700 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.9813 0.9473 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3142 1.8190 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4846 2.4871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8175 3.3588 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1101 3.8614 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7134 4.6434 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.9314 4.2467 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5719 -3.1969 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 3 2 0 0 0 0 1 4 2 0 0 0 0 1 7 1 0 0 0 0 1 14 1 0 0 0 0 2 11 1 0 0 0 0 2 35 1 0 0 0 0 5 9 1 0 0 0 0 5 11 1 0 0 0 0 5 23 1 0 0 0 0 6 7 2 0 0 0 0 6 10 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 12 2 0 0 0 0 9 13 2 0 0 0 0 10 11 2 0 0 0 0 12 15 1 0 0 0 0 12 24 1 0 0 0 0 13 16 1 0 0 0 0 13 25 1 0 0 0 0 14 18 2 0 0 0 0 14 19 1 0 0 0 0 15 16 2 0 0 0 0 15 26 1 0 0 0 0 16 27 1 0 0 0 0 17 20 2 0 0 0 0 17 21 1 0 0 0 0 17 22 1 0 0 0 0 18 20 1 0 0 0 0 18 28 1 0 0 0 0 19 21 2 0 0 0 0 19 29 1 0 0 0 0 20 30 1 0 0 0 0 21 31 1 0 0 0 0 22 32 1 0 0 0 0 22 33 1 0 0 0 0 22 34 1 0 0 0 0 M END $$$$