IBS-ZINC02221459 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 44 0 0 1 0 0 0 0 0999 V2000 0.0910 1.7370 -0.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0080 0.2470 0.0400 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.0670 0.0000 0.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5080 -0.5800 -1.1480 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 -1.0010 -1.2240 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4350 -0.7500 -2.1470 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1430 -1.4400 -3.3910 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -0.4400 -4.5070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3500 -1.1370 -5.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5670 -0.1200 -6.9750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 -0.7990 -8.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9090 0.1570 -9.5180 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9370 1.3890 -9.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.1580 1.2450 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2790 -1.2590 1.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7130 -1.9250 1.6740 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -1.6150 3.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7710 -2.7130 3.9220 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5800 -3.0140 5.0150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6900 -2.2180 5.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9890 -1.1230 4.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1840 -0.8120 3.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5170 0.2910 2.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.8240 0.5710 1.5840 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1160 2.0280 -0.5400 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5400 1.9910 -1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2330 2.3430 0.5680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3720 -0.3840 -2.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7040 -2.1200 -3.2510 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0260 -2.0400 -3.6340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6850 0.2710 -4.5830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0390 0.1480 -4.2530 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2120 -1.8130 -5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 -1.7530 -6.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2880 0.5670 -7.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4520 0.4880 -6.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6160 -1.4570 -8.3030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1360 -1.4300 -8.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0950 -3.3330 3.7010 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3480 -3.8670 5.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3250 -2.4500 6.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8580 -0.5080 4.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9990 -0.4210 -10.6410 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 14 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 7 30 1 0 0 0 0 8 9 1 0 0 0 0 8 31 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 9 34 1 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 1 0 0 0 0 11 37 1 0 0 0 0 11 38 1 0 0 0 0 12 13 2 0 0 0 0 12 43 1 0 0 0 0 14 15 1 0 0 0 0 14 24 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 39 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 41 1 0 0 0 0 21 22 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 23 24 2 0 0 0 0 M CHG 1 43 -1 M END