IBS-ZINC02140450 MOE2007 3D CORINA 3.40 0006 02.08.2006 68 72 0 0 1 0 0 0 0 0999 V2000 0.2290 0.6390 0.1590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1850 -0.8570 0.1830 C 0 0 3 0 0 0 0 0 0 0 0 0 0.6050 -1.5590 1.3130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1360 -1.1420 2.7110 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3630 -1.3370 2.9230 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2700 -0.7080 1.8340 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.7260 -1.0990 0.4110 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.5810 -0.5610 -0.7770 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1030 -1.2180 -2.0780 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.2160 -2.3100 -1.9990 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 -0.8800 -2.3090 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.4820 0.2040 -2.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2310 -1.4640 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3910 -1.3840 -3.6120 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -1.2010 -4.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6380 -1.3560 -5.5410 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.6940 -0.8100 -3.4150 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.8350 0.2740 -3.4880 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9270 -1.5880 -3.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.1880 -2.4840 -3.3230 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.3140 -2.4570 -2.3050 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.9010 -1.0560 -2.1700 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.8100 -0.0510 -1.8180 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6790 -0.0830 -2.8330 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.5030 -0.6680 -3.4150 O 0 0 0 0 0 0 0 0 0 0 0 0 -9.9110 -0.7400 -3.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.0330 -0.4200 -1.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.8970 -1.0680 -1.1380 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9350 -2.5450 0.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.4640 0.7990 2.0410 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5730 -1.3740 1.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3570 -1.2050 3.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2200 0.7590 -0.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4660 1.2620 -0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3170 1.0800 1.1530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5050 -2.6490 1.2220 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -1.3460 1.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6800 -1.7360 3.4560 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4020 -0.1000 2.9140 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -2.4150 2.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6280 -0.9410 3.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6330 -0.8110 -0.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5210 0.5290 -0.8510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2880 -1.2640 -1.4210 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -2.5580 -1.1970 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2720 -1.2420 -4.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6910 -2.6560 -3.9600 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7210 -3.4740 -3.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.5280 -2.2240 -4.3320 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.0940 -3.1630 -2.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.9550 -2.8100 -1.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2300 0.9630 -1.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4230 -0.2530 -0.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.0070 0.2120 -3.8350 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8730 0.5820 -2.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.4480 -0.0400 -3.8230 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.2410 -1.7610 -3.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.9400 0.6550 -1.5270 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9580 -0.7880 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7590 -2.6910 0.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5490 1.3770 1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2150 1.1990 1.3510 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8330 1.0140 3.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.8140 -1.5040 3.9450 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7140 -0.1760 3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2350 -1.8510 2.9540 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1120 -1.4850 -2.9270 N 0 3 0 0 0 0 0 0 0 0 0 0 -4.7860 -1.7730 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 2 3 1 0 0 0 0 2 7 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 1 0 0 0 0 4 38 1 0 0 0 0 4 39 1 0 0 0 0 5 6 1 0 0 0 0 5 40 1 0 0 0 0 5 41 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 6 31 1 0 0 0 0 7 8 1 0 0 0 0 7 29 1 0 0 0 0 8 9 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 17 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 14 1 0 0 0 0 13 44 1 0 0 0 0 13 45 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 19 46 1 0 0 0 0 19 47 1 0 0 0 0 19 67 1 0 0 0 0 20 21 1 0 0 0 0 20 48 1 0 0 0 0 20 49 1 0 0 0 0 20 67 1 0 0 0 0 21 22 1 0 0 0 0 21 50 1 0 0 0 0 21 51 1 0 0 0 0 22 23 1 0 0 0 0 22 25 1 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 52 1 0 0 0 0 23 53 1 0 0 0 0 24 54 1 0 0 0 0 24 55 1 0 0 0 0 24 67 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 26 57 1 0 0 0 0 27 28 1 0 0 0 0 27 58 1 0 0 0 0 27 59 1 0 0 0 0 29 60 1 0 0 0 0 30 61 1 0 0 0 0 30 62 1 0 0 0 0 30 63 1 0 0 0 0 31 32 1 0 0 0 0 32 64 1 0 0 0 0 32 65 1 0 0 0 0 32 66 1 0 0 0 0 67 68 1 0 0 0 0 M CHG 1 67 1 M END