IBS-ZINC05030093 MOE2007 3D CORINA 3.40 0006 02.08.2006 49 52 0 0 1 0 0 0 0 0999 V2000 0.7550 -0.0510 -2.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4030 -0.8330 -1.2260 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0390 -1.7150 -1.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6200 0.0560 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -0.7140 1.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2530 -1.1490 1.1290 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4090 -1.9970 -0.0590 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.0640 -1.2650 -1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -2.5150 -0.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8840 -3.9160 -0.2100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0980 -4.4210 -0.2820 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.1610 -3.6030 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4650 -4.1170 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5290 -3.2660 -0.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3420 -1.8880 -0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0900 -1.3550 -0.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9710 -2.2020 -0.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -1.7020 -0.1300 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.7850 -4.7620 -0.2100 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.9880 -6.3840 -0.4740 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.6900 -6.9610 -0.4450 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.0430 -6.8010 0.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.5810 -6.5740 -2.1220 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6860 -6.7250 -3.1650 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1510 -6.8740 -4.4580 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 -6.8710 -4.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4060 -6.7200 -3.6650 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9410 -6.5770 -2.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0950 -7.0580 -6.3330 Cl 0 0 0 0 0 0 0 0 0 0 0 0 1.8000 0.2580 -2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5990 -0.6840 -3.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 0.8310 -2.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 0.3300 0.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 0.9570 -0.0900 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8410 -1.5950 1.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3210 -0.0720 2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -1.7100 2.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8870 -0.2670 1.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6990 -0.3840 -1.3710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2190 -1.9100 -2.1490 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6250 -5.1830 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.5300 -3.6650 -0.4160 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.2000 -1.2330 -0.2850 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9590 -0.2840 -0.1520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8970 -4.4040 -0.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6240 -6.7260 -2.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4520 -6.9910 -5.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4680 -6.7180 -3.8600 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6390 -6.4640 -1.5560 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 35 1 0 0 0 0 5 36 1 0 0 0 0 6 7 1 0 0 0 0 6 37 1 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 8 39 1 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 10 19 1 0 0 0 0 11 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 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 15 16 2 0 0 0 0 15 43 1 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 1 0 0 0 0 19 20 1 0 0 0 0 19 45 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 46 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 2 0 0 0 0 26 29 1 0 0 0 0 27 28 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 M END