IBS-ZINC02292812 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 37 0 0 0 0 0 0 0 0999 V2000 -0.0790 1.5620 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0400 0.1090 -0.0040 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0080 -0.6570 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -0.2360 2.2990 O 0 0 0 0 0 0 0 0 0 0 0 0 0.0410 -2.1010 0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -3.0140 1.7860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1230 -4.4280 1.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1290 -5.4010 2.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1670 -6.6690 1.9760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1850 -6.4330 0.6190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1600 -5.0860 0.4030 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2210 -7.2820 -0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3050 -6.7260 -1.8610 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3360 -7.5390 -2.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2860 -8.9230 -2.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1980 -9.5030 -1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1690 -8.6830 -0.4510 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2920 -9.9850 -4.3120 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.5560 -11.1000 -3.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.2950 -9.1230 -5.3350 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8150 -10.3720 -4.5620 N 0 5 0 0 0 0 0 0 0 0 0 0 2.0960 -10.9200 -3.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0050 -2.3020 -0.8950 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.0490 -0.5730 -1.2050 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 0.0640 -2.7470 S 0 0 0 0 0 0 0 0 0 0 0 0 0.7870 1.9790 -0.4280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 1.9290 -0.3840 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 1.8980 1.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -2.6680 2.8180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1070 -5.2110 3.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1800 -7.6340 2.4620 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3450 -5.6470 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3970 -7.0910 -3.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1510 -10.5830 -1.4760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1000 -9.1570 0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 3 4 2 0 0 0 0 3 5 1 0 0 0 0 5 6 2 0 0 0 0 5 23 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 8 30 1 0 0 0 0 9 10 2 0 0 0 0 9 31 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 2 0 0 0 0 13 14 2 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 2 0 0 0 0 15 18 1 0 0 0 0 16 17 1 0 0 0 0 16 34 1 0 0 0 0 17 35 1 0 0 0 0 18 19 2 0 0 0 0 18 20 2 0 0 0 0 18 21 1 0 0 0 0 21 22 1 0 0 0 0 23 24 1 0 0 0 0 24 25 2 0 0 0 0 M CHG 1 21 -1 M END