IBS-ZINC02330259 MOE2007 3D CORINA 3.40 0006 02.08.2006 60 64 0 0 1 0 0 0 0 0999 V2000 -0.1680 1.2890 0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1010 -0.0960 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1430 -0.7260 0.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 0.0020 0.1230 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2540 1.4180 0.0700 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0090 2.0330 0.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3440 2.1950 0.0130 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5230 1.5260 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8610 1.9960 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6800 0.8720 0.0160 C 0 0 0 0 0 0 0 0 0 0 0 0 5.8740 -0.2470 0.0350 N 0 0 0 0 0 0 0 0 0 0 0 0 4.5600 0.1410 0.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4860 -0.6690 0.1190 N 0 0 0 0 0 0 0 0 0 0 0 0 6.3080 -1.6340 0.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 6.5790 -2.1470 1.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 7.0990 -3.5620 1.4260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4790 -3.8120 1.4640 C 0 0 0 0 0 0 0 0 0 0 0 0 8.9600 -5.1210 1.4310 C 0 0 0 0 0 0 0 0 0 0 0 0 8.0540 -6.1800 1.3580 C 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 -5.9520 1.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2040 -4.6410 1.3390 C 0 0 0 0 0 0 0 0 0 0 0 0 8.6810 -7.8710 1.3290 S 0 0 0 0 0 0 0 0 0 0 0 0 7.6250 -8.6030 0.6330 O 0 0 0 0 0 0 0 0 0 0 0 0 9.9260 -7.7430 0.5750 O 0 0 0 0 0 0 0 0 0 0 0 0 8.8690 -8.2840 2.8540 N 0 5 0 0 0 0 0 0 0 0 0 0 7.9520 -8.2930 3.2540 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0230 0.7740 0.0880 N 0 0 0 0 0 0 0 0 0 0 0 0 6.2830 3.3830 -0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 5.6740 4.3010 0.4130 O 0 0 0 0 0 0 0 0 0 0 0 0 7.4070 3.5750 -0.9050 N 0 0 0 0 0 0 0 0 0 0 0 0 8.0130 4.8780 -1.1100 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5820 5.4790 -2.4540 C 0 0 3 0 0 0 0 0 0 0 0 0 6.4920 5.4270 -2.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0750 6.9070 -2.6440 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3940 6.7170 -3.3490 C 0 0 0 0 0 0 0 0 0 0 0 0 9.1020 5.5280 -4.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1790 4.6990 -3.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 1.7940 0.1360 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0110 -0.6880 0.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1910 -1.8120 0.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9530 3.1190 0.0360 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5320 -2.2310 -0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1990 -1.7080 -0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 7.2990 -1.4990 1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0 5.6640 -2.1030 2.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 9.1890 -2.9910 1.5240 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0290 -5.3160 1.4680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9830 -6.7840 1.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1320 -4.4620 1.3000 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6220 1.5900 0.1910 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5300 -0.1070 0.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8110 2.7790 -1.3870 H 0 0 0 0 0 0 0 0 0 0 0 0 7.7350 5.5400 -0.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 9.0960 4.7180 -1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3860 7.4460 -3.3070 H 0 0 0 0 0 0 0 0 0 0 0 0 8.1550 7.4780 -1.7140 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7230 7.5950 -3.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1740 6.4620 -2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6170 5.8360 -5.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.9990 4.9530 -4.4800 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 38 1 0 0 0 0 2 3 2 0 0 0 0 2 39 1 0 0 0 0 3 4 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 13 2 0 0 0 0 5 6 1 0 0 0 0 5 7 2 0 0 0 0 6 41 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 8 12 2 0 0 0 0 9 10 2 0 0 0 0 9 28 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 1 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 46 1 0 0 0 0 18 19 1 0 0 0 0 18 47 1 0 0 0 0 19 20 2 0 0 0 0 19 22 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 21 49 1 0 0 0 0 22 23 2 0 0 0 0 22 24 2 0 0 0 0 22 25 1 0 0 0 0 25 26 1 0 0 0 0 27 50 1 0 0 0 0 27 51 1 0 0 0 0 28 29 2 0 0 0 0 28 30 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 31 32 1 0 0 0 0 31 53 1 0 0 0 0 31 54 1 0 0 0 0 32 33 1 0 0 0 0 32 34 1 0 0 0 0 32 37 1 0 0 0 0 34 35 1 0 0 0 0 34 55 1 0 0 0 0 34 56 1 0 0 0 0 35 36 1 0 0 0 0 35 57 1 0 0 0 0 35 58 1 0 0 0 0 36 37 1 0 0 0 0 36 59 1 0 0 0 0 36 60 1 0 0 0 0 M CHG 1 25 -1 M END