IBS-ZINC06662155 MOE2007 3D CORINA 3.40 0006 02.08.2006 43 45 0 0 0 0 0 0 0 0999 V2000 -0.0940 1.4740 0.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1280 0.1100 -0.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0610 -0.5910 -0.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2820 0.0790 -0.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3180 1.4370 0.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1300 2.1420 0.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6240 2.1110 0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6700 3.3010 0.4380 O 0 0 0 0 0 0 0 0 0 0 0 0 4.7530 1.3280 -0.1310 N 0 0 0 0 0 0 0 0 0 0 0 0 4.7140 -0.0390 -0.3970 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7130 -0.7360 -0.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4720 -0.6150 -0.4440 N 0 0 0 0 0 0 0 0 0 0 0 0 3.4520 -1.6070 -0.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0590 1.9950 -0.1180 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6290 2.1210 1.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9360 2.8980 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4740 3.2100 0.2260 O 0 0 0 0 0 0 0 0 0 0 0 0 8.4700 3.2400 2.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 9.6740 4.0700 2.5860 C 0 0 0 0 0 0 0 0 0 0 0 0 10.7470 3.4520 3.4760 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1990 3.1400 4.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9570 2.2490 4.7510 C 0 0 0 0 0 0 0 0 0 0 0 0 7.9060 2.8700 3.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2300 2.4850 5.8110 C 0 0 0 0 0 0 0 0 0 0 0 0 12.4150 2.4220 5.3810 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 2.0170 0.3620 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0820 -0.4080 -0.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0190 -1.6530 -0.5390 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1490 3.2050 0.5040 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7590 1.4450 -0.7580 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9410 2.9920 -0.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9080 2.6440 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8100 1.1250 1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0840 4.2410 1.5860 H 0 0 0 0 0 0 0 0 0 0 0 0 9.3710 5.0470 2.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1190 2.5310 3.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5970 4.1410 3.5460 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9090 4.0870 5.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 9.2490 1.2660 4.3580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5050 2.0730 5.7350 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5070 3.7880 4.2800 H 0 0 0 0 0 0 0 0 0 0 0 0 7.0730 2.1720 3.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7740 2.1130 6.9310 O 0 5 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 26 1 0 0 0 0 2 3 2 0 0 0 0 2 27 1 0 0 0 0 3 4 1 0 0 0 0 3 28 1 0 0 0 0 4 5 2 0 0 0 0 4 12 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 29 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 30 1 0 0 0 0 14 31 1 0 0 0 0 15 16 1 0 0 0 0 15 32 1 0 0 0 0 15 33 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 23 1 0 0 0 0 19 20 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 21 22 1 0 0 0 0 21 24 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 2 0 0 0 0 24 43 1 0 0 0 0 M CHG 1 43 -1 M END