IBS-ZINC02106378 MOE2007 3D CORINA 3.40 0006 02.08.2006 64 67 0 0 1 0 0 0 0 0999 V2000 -0.3510 0.0580 -0.9320 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0230 -1.2480 -0.5100 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5960 -1.3590 0.7260 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9420 -2.6570 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5390 -2.9090 2.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8090 -1.8660 3.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4490 -0.5700 2.8560 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8500 -0.3160 1.6130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4790 -2.2040 4.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 2.7790 -3.2580 4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 -2.1700 5.8660 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1500 -2.8430 6.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2190 -2.7630 5.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5250 -2.8650 7.0080 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5690 -1.5300 7.7430 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8290 -0.9300 7.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5700 -0.7970 6.5690 C 0 0 3 0 0 0 0 0 0 0 0 0 2.9820 -0.2470 6.7810 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7630 -0.1700 5.4780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7760 -1.5630 3.6290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2310 -1.6280 4.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4650 -2.0050 5.2420 O 0 0 0 0 0 0 0 0 0 0 0 0 7.1400 -1.2430 3.1240 N 0 0 0 0 0 0 0 0 0 0 0 0 8.5490 -1.1900 3.2520 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2450 -1.5320 4.4110 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6430 -1.4450 4.4490 C 0 0 0 0 0 0 0 0 0 0 0 0 11.3670 -1.0160 3.3350 C 0 0 0 0 0 0 0 0 0 0 0 0 10.6770 -0.6740 2.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 9.2790 -0.7610 2.1350 C 0 0 0 0 0 0 0 0 0 0 0 0 12.7230 -0.9760 3.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 13.5070 -0.5460 2.4060 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8590 0.1320 5.7530 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5220 0.7150 -1.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7890 -0.0260 -1.9310 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1130 0.4830 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7430 -3.4820 0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7860 -3.9410 2.5820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 0.2800 3.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5900 0.7110 1.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3710 -2.1480 4.9870 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2910 -3.7640 5.2330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5450 -3.2240 6.8320 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0310 -3.6120 7.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2070 -0.8290 7.1900 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0310 -1.6680 8.7270 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 0.0530 8.3910 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4070 -1.5610 8.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9320 0.7620 7.2090 H 0 0 0 0 0 0 0 0 0 0 0 0 3.5300 -0.8740 7.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3280 0.5340 4.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7910 0.1470 5.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5810 -0.6770 3.0170 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5720 -2.4780 3.0640 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7840 -0.9650 2.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7390 -1.8740 5.3080 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1720 -1.7150 5.3610 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1940 -0.3360 1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7740 -0.4850 1.2120 H 0 0 0 0 0 0 0 0 0 0 0 0 13.3910 -1.2220 1.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2660 0.4860 2.1290 H 0 0 0 0 0 0 0 0 0 0 0 0 14.5580 -0.5720 2.7110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5320 0.8600 6.3130 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8280 -1.5300 4.8330 N 0 3 0 0 0 0 0 0 0 0 0 0 4.3240 -2.1240 5.5210 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 3 4 1 0 0 0 0 3 8 2 0 0 0 0 4 5 2 0 0 0 0 4 36 1 0 0 0 0 5 6 1 0 0 0 0 5 37 1 0 0 0 0 6 7 2 0 0 0 0 6 9 1 0 0 0 0 7 8 1 0 0 0 0 7 38 1 0 0 0 0 8 39 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 63 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 17 1 0 0 0 0 13 14 1 0 0 0 0 13 40 1 0 0 0 0 13 41 1 0 0 0 0 14 15 1 0 0 0 0 14 42 1 0 0 0 0 14 43 1 0 0 0 0 15 16 1 0 0 0 0 15 44 1 0 0 0 0 15 45 1 0 0 0 0 16 17 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 17 18 1 0 0 0 0 17 32 1 0 0 0 0 18 19 1 0 0 0 0 18 48 1 0 0 0 0 18 49 1 0 0 0 0 19 50 1 0 0 0 0 19 51 1 0 0 0 0 19 63 1 0 0 0 0 20 21 1 0 0 0 0 20 52 1 0 0 0 0 20 53 1 0 0 0 0 20 63 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 23 54 1 0 0 0 0 24 25 1 0 0 0 0 24 29 2 0 0 0 0 25 26 2 0 0 0 0 25 55 1 0 0 0 0 26 27 1 0 0 0 0 26 56 1 0 0 0 0 27 28 2 0 0 0 0 27 30 1 0 0 0 0 28 29 1 0 0 0 0 28 57 1 0 0 0 0 29 58 1 0 0 0 0 30 31 1 0 0 0 0 31 59 1 0 0 0 0 31 60 1 0 0 0 0 31 61 1 0 0 0 0 32 62 1 0 0 0 0 63 64 1 0 0 0 0 M CHG 1 63 1 M END