IBS-ZINC04025880 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 63 0 0 1 0 0 0 0 0999 V2000 1.0360 2.5520 -0.4120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5270 1.1480 -0.7510 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1360 0.7680 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7540 0.2250 0.4670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0990 -1.1280 0.3480 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8510 -1.3670 -0.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3580 -0.3370 -1.5390 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9630 1.1140 -1.1810 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.5680 1.4230 -0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2690 2.0730 -2.3550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7010 2.1700 -2.6830 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5220 3.0620 -1.8530 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4910 4.5020 -2.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4120 5.4020 -1.5600 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8520 7.1340 -3.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.8620 7.7850 -0.9610 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1890 1.4330 -3.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4760 0.7130 -4.4640 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.6650 1.5310 -4.0550 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5290 -2.1910 1.3360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8860 -2.8110 0.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -3.8960 1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1680 -5.2270 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6050 -5.8910 0.5470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6280 -6.1840 2.8420 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 2.5080 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 3.1820 -1.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3860 3.0450 0.3170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8360 0.1000 0.6010 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3750 0.7070 1.3780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3000 -2.3550 -0.6460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9810 -0.6000 -2.5350 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4510 -0.4130 -1.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9370 3.0900 -2.1260 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7070 1.7560 -3.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5540 2.6990 -1.8290 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 3.0230 -0.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4650 4.8860 -2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7880 4.5070 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4660 5.1210 -1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1310 5.3580 -0.5020 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9090 6.8580 -3.3520 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2930 6.5580 -4.0940 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7270 8.2010 -3.5610 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 7.6070 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.9330 7.5810 -0.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6810 8.8110 -1.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9670 2.5720 -4.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8880 0.9920 -4.9810 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2380 1.0720 -3.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5610 -1.7510 2.3410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2300 -2.9840 1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8800 -3.1810 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6720 -2.0470 1.0160 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6710 -3.5300 2.8980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3950 -6.4340 0.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8260 -6.6070 0.8310 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1480 -5.1900 -0.1550 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0380 -5.6670 3.7160 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7910 -6.8020 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4090 -6.8430 2.4500 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2770 6.8510 -1.9910 N 0 3 0 0 0 0 0 0 0 0 0 0 -3.2710 7.0650 -2.0350 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 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 29 1 0 0 0 0 4 30 1 0 0 0 0 5 6 2 0 0 0 0 5 20 1 0 0 0 0 6 7 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 32 1 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 17 1 0 0 0 0 12 13 1 0 0 0 0 12 36 1 0 0 0 0 12 37 1 0 0 0 0 13 14 1 0 0 0 0 13 38 1 0 0 0 0 13 39 1 0 0 0 0 14 40 1 0 0 0 0 14 41 1 0 0 0 0 14 62 1 0 0 0 0 15 42 1 0 0 0 0 15 43 1 0 0 0 0 15 44 1 0 0 0 0 15 62 1 0 0 0 0 16 45 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 16 62 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 48 1 0 0 0 0 19 49 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 51 1 0 0 0 0 20 52 1 0 0 0 0 21 22 1 0 0 0 0 21 53 1 0 0 0 0 21 54 1 0 0 0 0 22 23 2 0 0 0 0 22 55 1 0 0 0 0 23 24 1 0 0 0 0 23 25 1 0 0 0 0 24 56 1 0 0 0 0 24 57 1 0 0 0 0 24 58 1 0 0 0 0 25 59 1 0 0 0 0 25 60 1 0 0 0 0 25 61 1 0 0 0 0 62 63 1 0 0 0 0 M CHG 1 62 1 M END