IBS-ZINC04029604 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 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 0.7400 -0.5180 1.2370 C 0 0 3 0 0 0 0 0 0 0 0 0 0.8470 -1.6000 1.1730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0100 -0.1540 2.5290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8510 -0.6610 3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2640 -0.0820 3.6310 C 0 0 3 0 0 0 0 0 0 0 0 0 2.8610 -0.3910 2.3660 O 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 0.1330 1.2640 C 0 0 3 0 0 0 0 0 0 0 0 0 2.0100 1.2080 1.3980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8060 -0.1060 -0.0530 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1850 -0.0490 -0.1330 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8230 -0.2600 -1.3400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0800 -0.5290 -2.4750 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7040 -0.5900 -2.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0560 -0.3820 -1.1870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7010 -0.4720 -1.1550 O 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -0.6770 4.7520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2010 1.3800 3.7950 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1510 2.5460 3.9260 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0880 4.0070 4.0900 C 0 0 0 0 0 0 0 0 0 0 0 0 3.4440 4.5670 4.0160 N 0 3 0 0 0 0 0 0 0 0 0 0 3.3800 6.0240 4.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7960 6.6040 4.1850 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4840 6.2670 2.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4790 4.7490 2.6630 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0370 4.2380 2.7150 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2690 3.9910 5.0870 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4310 -0.5410 -0.0050 C 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 -0.1030 0.9280 2.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -0.6290 2.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3850 -0.3520 4.6440 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9040 -1.7490 3.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7670 0.1620 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9010 -0.2150 -1.3970 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5780 -0.6910 -3.4200 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1270 -0.7990 -3.2900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1610 -1.7600 4.6400 H 0 0 0 0 0 0 0 0 0 0 0 0 4.1260 -0.2660 4.6990 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6750 -0.4290 5.7170 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4740 4.4360 3.2980 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6490 4.2450 5.0590 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8130 6.4570 3.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8870 6.2620 5.1230 H 0 0 0 0 0 0 0 0 0 0 0 0 4.7460 7.6860 4.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3640 6.1710 5.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9450 6.7420 2.0380 H 0 0 0 0 0 0 0 0 0 0 0 0 6.5120 6.6290 2.8790 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9170 4.5050 1.6950 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0600 4.2780 3.4550 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0300 3.1570 2.5760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4570 4.7090 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3160 2.9090 4.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2760 4.4060 5.0330 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8290 4.2320 6.0540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9480 -0.1820 -0.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4100 -1.6300 -0.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9540 -0.1920 0.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 2 3 1 0 0 0 0 2 17 1 0 0 0 0 2 29 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 9 1 0 0 0 0 5 6 1 0 0 0 0 5 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 18 1 0 0 0 0 7 19 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 16 2 0 0 0 0 12 13 2 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 14 15 2 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 40 1 0 0 0 0 16 17 1 0 0 0 0 18 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 3 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 27 1 0 0 0 0 22 28 1 0 0 0 0 23 24 1 0 0 0 0 23 46 1 0 0 0 0 23 47 1 0 0 0 0 24 25 1 0 0 0 0 24 48 1 0 0 0 0 24 49 1 0 0 0 0 25 26 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 26 53 1 0 0 0 0 27 54 1 0 0 0 0 27 55 1 0 0 0 0 28 56 1 0 0 0 0 28 57 1 0 0 0 0 28 58 1 0 0 0 0 29 59 1 0 0 0 0 29 60 1 0 0 0 0 29 61 1 0 0 0 0 M CHG 1 22 1 M END