BXIR36 -OEChem-04012112532D 32 32 0 1 0 0 0 0 0999 V2000 5.6178 -3.1432 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1779 3.7846 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0488 -3.4522 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7602 3.0801 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3644 1.9575 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8088 -3.7310 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5400 0.3394 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1278 -0.4696 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9467 1.2530 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7210 -1.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3590 2.0620 0.0000 C 0 0 3 0 0 0 0 0 0 0 0 0 4.3088 -2.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3088 -2.1921 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9998 -3.1432 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7657 2.9756 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8966 -1.3831 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0260 0.6861 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1093 -0.1065 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6418 -0.8163 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5585 -0.0236 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4607 0.9063 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3774 1.6990 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2070 -1.0364 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2904 -1.8291 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1068 1.4956 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 2.4591 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1122 1.3911 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8088 -4.3510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3982 -1.7475 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2610 -0.8815 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3950 -1.0187 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4301 4.3510 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 13 1 0 0 0 0 2 15 1 0 0 0 0 2 32 1 0 0 0 0 3 14 2 0 0 0 0 4 15 2 0 0 0 0 5 11 1 0 0 0 0 5 26 1 0 0 0 0 5 27 1 0 0 0 0 6 14 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 7 17 1 0 0 0 0 7 18 1 0 0 0 0 8 10 1 0 0 0 0 8 19 1 0 0 0 0 8 20 1 0 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 12 1 0 0 0 0 10 23 1 0 0 0 0 10 24 1 0 0 0 0 11 15 1 0 0 0 0 11 25 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 13 16 1 0 0 0 0 16 29 1 0 0 0 0 16 30 1 0 0 0 0 16 31 1 0 0 0 0 M END $$$$