DR2080 -OEChem-05042003293D 30 30 0 1 0 0 0 0 0999 V2000 -3.7205 0.2143 -0.0283 P 0 0 0 0 0 0 0 0 0 0 0 0 0.4658 0.9879 0.1831 O 0 0 0 0 0 0 0 0 0 0 0 0 0.9483 -2.6093 -0.3692 O 0 0 0 0 0 0 0 0 0 0 0 0 3.5375 -1.7120 0.5235 O 0 0 0 0 0 0 0 0 0 0 0 0 1.9426 2.7877 0.2275 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1425 0.3372 -0.3711 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.7545 0.0924 1.5839 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.0829 -1.2823 -0.5222 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5810 1.2988 -0.6081 O 0 0 0 0 0 0 0 0 0 0 0 0 4.1245 1.0127 -0.3638 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1837 -1.3235 0.1987 C 0 0 1 0 0 0 0 0 0 0 0 0 2.6022 -0.8910 -0.1789 C 0 0 1 0 0 0 0 0 0 0 0 0 2.8618 0.5721 0.1922 C 0 0 2 0 0 0 0 0 0 0 0 0 0.1555 -0.3137 -0.3177 C 0 0 1 0 0 0 0 0 0 0 0 0 1.7209 1.4757 -0.2881 C 0 0 1 0 0 0 0 0 0 0 0 0 -1.2613 -0.6471 0.1385 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1156 -1.4221 1.2897 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7673 -1.0640 -1.2500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1589 -0.2786 -1.4157 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9420 0.6562 1.2841 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6965 1.5401 -1.3839 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3178 -0.6358 1.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5685 -1.6307 -0.2273 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0959 0.9666 -1.3818 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8701 0.3803 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1386 -2.9673 0.0317 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3983 -1.5811 1.4769 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4812 3.4074 -0.3628 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6225 0.0754 2.0403 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.0193 -1.5738 -0.5056 H 0 0 0 0 0 0 0 0 0 0 0 0 1 6 1 0 0 0 0 1 7 1 0 0 0 0 1 8 1 0 0 0 0 1 9 2 0 0 0 0 2 14 1 0 0 0 0 2 15 1 0 0 0 0 3 11 1 0 0 0 0 3 26 1 0 0 0 0 4 12 1 0 0 0 0 4 27 1 0 0 0 0 5 15 1 0 0 0 0 5 28 1 0 0 0 0 6 16 1 0 0 0 0 7 29 1 0 0 0 0 8 30 1 0 0 0 0 10 13 1 0 0 0 0 10 24 1 0 0 0 0 10 25 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 18 1 0 0 0 0 13 15 1 0 0 0 0 13 20 1 0 0 0 0 14 16 1 0 0 0 0 14 19 1 0 0 0 0 15 21 1 0 0 0 0 16 22 1 0 0 0 0 16 23 1 0 0 0 0 M END $$$$