B5OBT1 -OEChem-04012114332D 33 33 0 1 0 0 0 0 0999 V2000 5.7320 -0.8871 0.0000 S 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 2.3450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 5.4641 0.8450 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2320 1.7110 0.0000 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 0.8450 0.0000 C 0 0 2 0 0 0 0 0 0 0 0 0 2.8660 0.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2320 -0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -0.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2320 -0.0210 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5981 1.3450 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -1.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0000 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7320 -2.1550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -2.6550 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 -0.8871 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6540 0.9276 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2554 0.2373 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6494 -0.2331 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3397 -0.6316 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8147 0.1910 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1244 0.5896 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 1.7110 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5420 2.2480 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -0.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -0.8450 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4631 -2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 -2.4650 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1350 2.6550 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8660 -3.2750 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 -1.5070 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3520 -0.8871 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7320 -0.2671 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 1 9 1 0 0 0 0 1 16 1 0 0 0 0 2 10 1 0 0 0 0 2 29 1 0 0 0 0 3 10 2 0 0 0 0 5 4 1 1 0 0 0 4 23 1 0 0 0 0 4 24 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 10 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 6 18 1 0 0 0 0 7 9 1 0 0 0 0 7 19 1 0 0 0 0 7 20 1 0 0 0 0 8 11 2 0 0 0 0 8 12 1 0 0 0 0 9 21 1 0 0 0 0 9 22 1 0 0 0 0 11 13 1 0 0 0 0 11 25 1 0 0 0 0 12 14 2 0 0 0 0 12 26 1 0 0 0 0 13 15 2 0 0 0 0 13 27 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 15 30 1 0 0 0 0 16 31 1 0 0 0 0 16 32 1 0 0 0 0 16 33 1 0 0 0 0 M END $$$$