IBS-ZINC02327833 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 67 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4250 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2010 -0.6380 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3750 0.1000 0.0250 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5980 -0.5430 0.0330 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6570 -1.9240 0.0260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4880 -2.6700 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2560 -2.0260 -0.0030 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1070 -2.7550 -0.0230 O 0 0 0 0 0 0 0 0 0 0 0 0 0.4560 -3.1140 1.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.5470 -4.0280 0.0040 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.8480 -4.6210 0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8710 0.2640 0.0500 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.6670 1.2780 0.3930 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4800 0.2960 -1.3250 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.3490 0.6460 -2.6310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.5020 0.2670 -3.2560 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.6920 0.3920 -4.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.3010 -0.2800 -2.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.7560 -0.3020 -1.2090 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9430 -0.6990 0.1980 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9370 -1.2440 0.6380 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8600 -0.3740 0.9260 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.6940 -0.6180 2.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.2140 0.5870 3.1470 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0430 0.3360 4.6230 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8770 0.7180 5.2590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7200 0.4880 6.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.7290 -0.1240 7.3310 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8960 -0.5050 6.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.0550 -0.2710 5.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1820 1.3090 -3.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 2.5930 -3.7830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 3.2060 -4.3640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9980 2.5520 -4.4240 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8630 1.2780 -3.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9480 0.6520 -3.3120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8160 -0.5970 -2.7950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 1.8020 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5440 1.7860 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5280 1.7760 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3330 1.1800 0.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6150 -2.4230 0.0320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2620 -3.7150 1.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3670 -3.6910 1.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6910 -2.2110 1.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3830 -4.3090 0.9100 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4000 -4.3000 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -5.7070 0.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2560 -1.5080 2.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6380 -0.7690 2.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6530 1.4760 2.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2710 0.7370 2.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0880 1.1960 4.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8080 0.7860 7.1090 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6060 -0.3040 8.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.6850 -0.9840 7.2580 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9680 -0.5660 4.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2550 3.1070 -3.7390 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3120 4.2010 -4.7740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1480 3.0380 -4.8800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9100 0.7730 -3.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9980 -1.3060 -3.4270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 39 1 0 0 0 0 1 40 1 0 0 0 0 1 41 1 0 0 0 0 2 3 1 0 0 0 0 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 13 1 0 0 0 0 6 7 2 0 0 0 0 6 43 1 0 0 0 0 7 8 1 0 0 0 0 7 11 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 10 44 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 12 49 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 13 23 1 0 0 0 0 15 16 2 0 0 0 0 15 20 1 0 0 0 0 16 17 1 0 0 0 0 16 32 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 20 2 0 0 0 0 20 21 1 0 0 0 0 21 22 2 0 0 0 0 21 23 1 0 0 0 0 23 24 1 0 0 0 0 24 25 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 31 2 0 0 0 0 27 28 2 0 0 0 0 27 54 1 0 0 0 0 28 29 1 0 0 0 0 28 55 1 0 0 0 0 29 30 2 0 0 0 0 29 56 1 0 0 0 0 30 31 1 0 0 0 0 30 57 1 0 0 0 0 31 58 1 0 0 0 0 32 33 1 0 0 0 0 32 37 2 0 0 0 0 33 34 2 0 0 0 0 33 59 1 0 0 0 0 34 35 1 0 0 0 0 34 60 1 0 0 0 0 35 36 2 0 0 0 0 35 61 1 0 0 0 0 36 37 1 0 0 0 0 36 62 1 0 0 0 0 37 38 1 0 0 0 0 38 63 1 0 0 0 0 M END