IBS-ZINC02398179 MOE2007 3D CORINA 3.40 0006 02.08.2006 63 66 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7630 -2.0410 1.2330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5030 -2.5480 2.4730 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5230 -4.0120 2.4650 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4980 -4.7690 1.8920 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2230 -6.1220 2.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9570 -6.2030 2.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5580 -4.8130 3.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5510 -4.5620 3.7040 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.3020 -5.5750 4.1550 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 -5.3160 4.8640 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2460 -6.3500 5.3190 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8630 -7.6720 5.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -7.9620 4.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9130 -6.9180 3.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2080 -7.1920 3.2480 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0310 -7.2440 1.5830 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9040 -7.7080 2.2940 O 0 0 0 0 0 0 0 0 0 0 0 0 2.8110 -7.7630 0.3590 N 0 0 0 0 0 0 0 0 0 0 0 0 3.6210 -8.8870 -0.1170 C 0 0 3 0 0 0 0 0 0 0 0 0 4.6390 -8.7860 0.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0190 -10.2000 0.3880 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6420 -8.8900 -1.6460 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3560 -7.6340 -2.1500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3760 -7.6370 -3.6560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3430 -7.0510 -4.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3610 -7.0530 -5.7450 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4130 -7.6420 -6.4210 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4470 -8.2280 -5.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4310 -8.2210 -4.3320 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5960 -4.2680 1.2430 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.3560 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2320 -0.1590 2.1380 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 -2.4180 1.2410 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2730 -2.3920 0.3360 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5250 -2.1700 2.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9930 -2.1960 3.3700 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8000 -4.2970 5.0460 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1570 -6.1450 5.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4810 -8.4760 5.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4380 -8.9910 4.2460 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1160 -7.3930 -0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6220 -11.0360 0.0340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0040 -10.1980 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0010 -10.3010 0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1700 -9.7750 -2.0010 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6190 -8.9010 -2.0230 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 -6.7490 -1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3790 -7.6230 -1.7730 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5200 -6.5910 -3.8340 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5530 -6.5960 -6.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 4.4270 -7.6450 -7.5010 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2690 -8.6880 -6.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2410 -8.6750 -3.7810 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7190 -3.3090 1.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2500 -4.8730 0.8590 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 34 1 0 0 0 0 1 35 1 0 0 0 0 1 36 1 0 0 0 0 2 3 1 0 0 0 0 2 37 1 0 0 0 0 2 38 1 0 0 0 0 3 4 1 0 0 0 0 3 39 1 0 0 0 0 3 40 1 0 0 0 0 4 5 1 0 0 0 0 4 41 1 0 0 0 0 4 42 1 0 0 0 0 5 6 1 0 0 0 0 5 43 1 0 0 0 0 5 44 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 2 0 0 0 0 7 33 1 0 0 0 0 8 9 1 0 0 0 0 8 19 1 0 0 0 0 9 10 1 0 0 0 0 9 18 2 0 0 0 0 10 11 2 0 0 0 0 11 12 1 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 45 1 0 0 0 0 14 15 1 0 0 0 0 14 46 1 0 0 0 0 15 16 2 0 0 0 0 15 47 1 0 0 0 0 16 17 1 0 0 0 0 16 48 1 0 0 0 0 17 18 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 21 49 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 50 1 0 0 0 0 24 51 1 0 0 0 0 24 52 1 0 0 0 0 25 26 1 0 0 0 0 25 53 1 0 0 0 0 25 54 1 0 0 0 0 26 27 1 0 0 0 0 26 55 1 0 0 0 0 26 56 1 0 0 0 0 27 28 1 0 0 0 0 27 32 2 0 0 0 0 28 29 2 0 0 0 0 28 57 1 0 0 0 0 29 30 1 0 0 0 0 29 58 1 0 0 0 0 30 31 2 0 0 0 0 30 59 1 0 0 0 0 31 32 1 0 0 0 0 31 60 1 0 0 0 0 32 61 1 0 0 0 0 33 62 1 0 0 0 0 33 63 1 0 0 0 0 M END