IBS-ZINC06661888 MOE2007 3D CORINA 3.40 0006 02.08.2006 38 39 0 0 0 0 0 0 0 0999 V2000 -0.1100 1.3550 0.1570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0280 -0.1570 0.0850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6590 -0.5110 -1.1200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8000 -1.8490 -1.3080 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4080 -2.7410 -0.5680 O 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -2.1400 -2.6030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -1.2020 -3.2890 O 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -3.4910 -2.8320 N 0 0 0 0 0 0 0 0 0 0 0 0 2.2650 -4.1140 -3.9090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3550 -5.4840 -4.0660 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0150 -5.8460 -5.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4200 -4.7200 -5.9730 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9810 -3.2720 -5.1920 S 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -4.7280 -7.2860 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6350 -6.0470 -7.5590 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7140 -7.1360 -7.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3200 -7.2070 -5.8240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4790 -8.4130 -7.7010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4820 -7.0250 -8.2400 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8190 -6.4010 -3.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2300 -5.8550 -2.0620 O 0 5 0 0 0 0 0 0 0 0 0 0 0.8920 1.7960 0.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6410 1.7540 -0.7130 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6290 1.6740 1.0650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5230 -0.5400 0.9510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0380 -0.5830 0.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2790 -4.1780 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4600 -4.4230 -8.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9840 -4.0480 -7.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1590 -7.6050 -5.2380 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4710 -7.8870 -5.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 5.4000 -8.5040 -7.1150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8730 -9.3110 -7.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7860 -8.3890 -8.7530 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7870 -6.8910 -9.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -7.9200 -8.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8540 -6.1650 -7.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9700 -7.6500 -3.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 2 3 1 0 0 0 0 2 25 1 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 27 1 0 0 0 0 9 10 2 0 0 0 0 9 13 1 0 0 0 0 10 11 1 0 0 0 0 10 20 1 0 0 0 0 11 12 2 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 28 1 0 0 0 0 14 29 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 18 1 0 0 0 0 16 19 1 0 0 0 0 17 30 1 0 0 0 0 17 31 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 34 1 0 0 0 0 19 35 1 0 0 0 0 19 36 1 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 2 0 0 0 0 M CHG 1 21 -1 M END