IBS-ZINC02255231 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 63 0 0 0 0 0 0 0 0999 V2000 0.2330 3.1070 0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6910 2.3470 -0.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 1.2020 -1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0700 0.8140 -1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 1.5630 -0.6160 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5750 2.7210 0.0510 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4710 1.1890 -0.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1830 1.5780 -1.7400 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5610 1.6400 -1.7720 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2680 1.3290 -0.8180 O 0 0 0 0 0 0 0 0 0 0 0 0 6.1020 2.0750 -3.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2890 1.5980 -3.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4250 2.2440 -4.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4130 2.0340 -5.7730 N 0 0 0 0 0 0 0 0 0 0 0 0 9.2990 1.1130 -5.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 10.3690 0.8130 -6.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3280 -0.1330 -5.8380 C 0 0 0 0 0 0 0 0 0 0 0 0 11.2180 -0.7940 -4.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 10.1490 -0.5040 -3.7780 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1870 0.4350 -4.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1850 0.6620 -3.2640 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3800 3.1210 -5.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 5.5670 3.0350 -3.9020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4820 3.8230 -3.7620 N 0 0 0 0 0 0 0 0 0 0 0 0 6.1990 3.9970 -6.1600 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2660 3.3830 -7.2010 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0410 4.3230 -8.3570 C 0 0 0 0 0 0 0 0 0 0 0 0 5.9310 4.3340 -9.4430 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7360 5.2120 -10.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 4.6460 6.0830 -10.4820 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7580 6.0990 -9.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9590 5.2170 -8.3450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3790 7.2110 -11.8640 S 0 0 0 0 0 0 0 0 0 0 0 0 3.7610 8.3710 -11.2270 O 0 0 0 0 0 0 0 0 0 0 0 0 5.7320 7.4430 -12.3630 O 0 0 0 0 0 0 0 0 0 0 0 0 3.4260 6.4310 -12.8720 N 0 5 0 0 0 0 0 0 0 0 0 0 2.5590 6.3000 -12.3900 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5170 -0.6070 -2.2150 Cl 0 0 0 0 0 0 0 0 0 0 0 0 -0.0910 4.0000 0.5420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7360 2.6450 -0.7260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0020 0.6160 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2800 3.3320 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9490 1.6650 0.3200 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5970 0.1100 -0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6670 1.7810 -2.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 10.4600 1.3300 -7.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 12.1560 -0.3490 -6.5070 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9580 -1.5340 -4.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0640 -1.0240 -2.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 3.9510 3.8700 -2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1300 4.4380 -4.4920 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8200 4.9580 -5.7930 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1870 4.2040 -6.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6790 2.4360 -7.5730 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3000 3.1220 -6.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7810 3.6550 -9.4630 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4210 5.2120 -11.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9160 6.7850 -9.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2620 5.2290 -7.5110 H 0 0 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 39 1 0 0 0 0 2 3 2 0 0 0 0 2 40 1 0 0 0 0 3 4 1 0 0 0 0 3 41 1 0 0 0 0 4 5 2 0 0 0 0 4 38 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 42 1 0 0 0 0 7 8 1 0 0 0 0 7 43 1 0 0 0 0 7 44 1 0 0 0 0 8 9 1 0 0 0 0 8 45 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 23 2 0 0 0 0 12 13 1 0 0 0 0 12 21 2 0 0 0 0 13 14 2 0 0 0 0 13 22 1 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 20 2 0 0 0 0 16 17 2 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 47 1 0 0 0 0 18 19 2 0 0 0 0 18 48 1 0 0 0 0 19 20 1 0 0 0 0 19 49 1 0 0 0 0 20 21 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 25 52 1 0 0 0 0 25 53 1 0 0 0 0 26 27 1 0 0 0 0 26 54 1 0 0 0 0 26 55 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 56 1 0 0 0 0 29 30 1 0 0 0 0 29 57 1 0 0 0 0 30 31 2 0 0 0 0 30 33 1 0 0 0 0 31 32 1 0 0 0 0 31 58 1 0 0 0 0 32 59 1 0 0 0 0 33 34 2 0 0 0 0 33 35 2 0 0 0 0 33 36 1 0 0 0 0 36 37 1 0 0 0 0 M CHG 1 36 -1 M END