IBS-ZINC01816817 MOE2007 3D CORINA 3.40 0006 02.08.2006 69 71 0 0 1 0 0 0 0 0999 V2000 -1.3410 1.8360 2.7230 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 0.4310 2.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6210 0.2080 0.7930 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4310 0.1200 -0.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -1.7470 1.6040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1950 -2.2240 1.7390 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2670 -3.6760 1.6990 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.3240 -4.5210 2.8850 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.4670 -4.2560 3.5160 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1150 -5.8780 2.2660 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 -7.0370 3.1410 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0770 -8.1270 2.6300 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3760 -9.5340 2.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2960 -10.2270 2.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6230 -9.2840 1.7790 N 0 0 0 0 0 0 0 0 0 0 0 0 1.5050 -9.5130 1.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -8.0160 2.0720 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0640 -6.8440 1.8010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0930 -11.6560 2.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8730 -12.5340 2.3900 O 0 0 0 0 0 0 0 0 0 0 0 0 1.1280 -11.8890 1.4700 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4440 -13.2730 1.3000 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6170 -10.1430 3.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3570 -7.0520 4.2770 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1490 -5.8360 0.9310 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0540 -6.8460 0.0250 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.2430 -4.4130 0.5380 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2260 -4.0190 -0.6150 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.6360 -4.3620 3.6320 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6280 -4.0790 5.0060 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8270 -3.9640 5.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0570 -4.1340 5.0760 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0780 -4.4060 3.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8790 -4.5190 2.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.1510 -4.0090 5.8890 O 0 0 0 0 0 0 0 0 0 0 0 0 -8.4170 -4.3130 5.3140 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4740 2.2920 3.7090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6760 2.4840 2.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3170 1.8220 2.2260 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1990 0.4210 3.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4760 -0.1670 3.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4430 -0.4230 1.1470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 1.2450 1.0690 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4050 0.7460 -1.0400 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3340 0.4720 -1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2410 -0.9040 -1.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -2.0660 2.4520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3010 -2.1640 0.6930 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6610 -1.8680 2.6610 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7770 -1.8380 0.8940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 -6.0360 2.5150 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1220 -7.1130 1.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -6.4630 0.7900 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -13.3410 0.8380 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4780 -13.7800 2.2690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7170 -13.7520 0.6360 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4000 -9.3970 3.4340 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0230 -10.8950 2.5900 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 -10.6230 4.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0850 -6.4280 -0.8580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6900 -3.9670 5.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8020 -3.7590 6.7840 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.0080 -4.5430 3.1680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9320 -4.7440 1.9320 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.1710 -4.2260 6.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.6730 -3.5950 4.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.4450 -5.3410 4.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6500 -0.2290 1.5100 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.4410 0.0900 0.9340 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 1 39 1 0 0 0 0 2 40 1 0 0 0 0 2 41 1 0 0 0 0 2 68 1 0 0 0 0 3 4 1 0 0 0 0 3 42 1 0 0 0 0 3 43 1 0 0 0 0 3 68 1 0 0 0 0 4 44 1 0 0 0 0 4 45 1 0 0 0 0 4 46 1 0 0 0 0 5 6 1 0 0 0 0 5 47 1 0 0 0 0 5 48 1 0 0 0 0 5 68 1 0 0 0 0 6 7 1 0 0 0 0 6 49 1 0 0 0 0 6 50 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 29 1 0 0 0 0 10 11 1 0 0 0 0 10 25 2 0 0 0 0 11 12 1 0 0 0 0 11 24 2 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 23 1 0 0 0 0 14 15 1 0 0 0 0 14 19 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 18 51 1 0 0 0 0 18 52 1 0 0 0 0 18 53 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 22 54 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 57 1 0 0 0 0 23 58 1 0 0 0 0 23 59 1 0 0 0 0 25 26 1 0 0 0 0 25 27 1 0 0 0 0 26 60 1 0 0 0 0 27 28 2 0 0 0 0 29 30 1 0 0 0 0 29 34 2 0 0 0 0 30 31 2 0 0 0 0 30 61 1 0 0 0 0 31 32 1 0 0 0 0 31 62 1 0 0 0 0 32 33 2 0 0 0 0 32 35 1 0 0 0 0 33 34 1 0 0 0 0 33 63 1 0 0 0 0 34 64 1 0 0 0 0 35 36 1 0 0 0 0 36 65 1 0 0 0 0 36 66 1 0 0 0 0 36 67 1 0 0 0 0 68 69 1 0 0 0 0 M CHG 1 68 1 M END