IBS-ZINC02108522 MOE2007 3D CORINA 3.40 0006 02.08.2006 67 70 0 0 1 0 0 0 0 0999 V2000 -0.2470 1.5280 -0.2630 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2200 -0.0020 -0.2680 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7820 -0.5010 0.7760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3540 -0.0360 2.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0300 -0.6060 2.4860 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0340 -0.0950 1.4540 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6150 -0.5400 0.0570 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.6040 -1.6290 0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6300 0.0020 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2860 -0.5100 -2.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8520 -0.1330 -2.6590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5420 0.4980 -3.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2200 -0.5030 -1.6490 C 0 0 3 0 0 0 0 0 0 0 0 0 1.1640 -0.0330 -1.9240 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3940 -2.0230 -1.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9520 -2.5060 -2.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1230 -4.0030 -2.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3060 -4.7080 -2.5940 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 -6.0180 -2.6820 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7250 -6.1430 -3.0370 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1780 -4.9240 -3.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2510 -4.6370 -3.5580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3540 -4.5370 -5.0160 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.6100 -5.6240 -5.7180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -5.5670 -7.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5480 -4.3490 -7.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2810 -3.2290 -6.9640 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1950 -3.3610 -5.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.4220 -0.6550 1.7730 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0800 1.4110 1.5020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4220 2.0090 2.3190 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8520 2.0870 0.6370 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8470 3.5350 0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6290 1.9080 -0.7870 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1500 1.8770 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2400 1.8880 0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8180 -1.5900 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7710 -0.1020 0.5480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0730 -0.3900 2.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3140 1.0530 2.1920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9920 -1.6950 2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3360 -0.2850 3.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6300 -0.3350 -0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 1.0920 -0.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3950 -1.5940 -2.3860 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9500 -0.0510 -3.0860 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 0.7560 -4.4740 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 0.7600 -3.9670 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0850 -2.2900 -0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5720 -2.4950 -1.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2610 -2.2390 -3.7510 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9180 -2.0340 -3.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2600 -4.2770 -2.3300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7010 -6.8320 -2.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8910 -5.4440 -3.2030 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5660 -3.6970 -3.1060 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7380 -6.5680 -5.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9230 -6.4610 -7.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6240 -4.2750 -8.8110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1450 -2.2640 -7.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9910 -2.4920 -4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7250 -0.3290 2.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.1390 -0.2910 1.0370 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3900 -1.7440 1.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5110 3.9560 -0.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1910 3.8290 1.7330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8350 3.9070 0.5830 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 7 1 0 0 0 0 2 13 1 0 0 0 0 3 4 1 0 0 0 0 3 37 1 0 0 0 0 3 38 1 0 0 0 0 4 5 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 5 6 1 0 0 0 0 5 41 1 0 0 0 0 5 42 1 0 0 0 0 6 7 1 0 0 0 0 6 29 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 1 0 0 0 0 10 45 1 0 0 0 0 10 46 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 12 47 1 0 0 0 0 12 48 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 49 1 0 0 0 0 15 50 1 0 0 0 0 16 17 1 0 0 0 0 16 51 1 0 0 0 0 16 52 1 0 0 0 0 17 18 1 0 0 0 0 17 21 2 0 0 0 0 18 19 2 0 0 0 0 18 53 1 0 0 0 0 19 20 1 0 0 0 0 19 54 1 0 0 0 0 20 21 1 0 0 0 0 21 22 1 0 0 0 0 22 23 1 0 0 0 0 22 55 1 0 0 0 0 22 56 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 57 1 0 0 0 0 25 26 1 0 0 0 0 25 58 1 0 0 0 0 26 27 2 0 0 0 0 26 59 1 0 0 0 0 27 28 1 0 0 0 0 27 60 1 0 0 0 0 28 61 1 0 0 0 0 29 62 1 0 0 0 0 29 63 1 0 0 0 0 29 64 1 0 0 0 0 30 31 2 0 0 0 0 30 32 1 0 0 0 0 32 33 1 0 0 0 0 33 65 1 0 0 0 0 33 66 1 0 0 0 0 33 67 1 0 0 0 0 M CHG 1 23 1 M END