IBS-ZINC05033799 MOE2007 3D CORINA 3.40 0006 02.08.2006 59 61 0 0 1 0 0 0 0 0999 V2000 0.6300 -1.8700 -0.2750 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8500 -1.9240 -0.6120 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7370 -0.3760 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3440 0.0380 -2.6580 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8020 -0.3190 1.0810 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7830 1.1820 1.4100 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4900 1.4800 2.6450 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.8210 1.7250 3.9170 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.1610 2.5870 3.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 2.1230 4.8480 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.2150 1.9400 4.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8630 1.5520 2.7120 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.6700 1.3360 1.8250 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.3670 2.0450 4.5020 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.8770 2.5860 6.1000 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9940 2.9120 6.8310 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.5960 2.7730 6.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8240 3.9190 6.5540 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4120 4.0700 7.1840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8680 3.0780 8.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1060 1.9440 8.3030 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1320 1.7920 7.6780 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0610 3.2190 8.6390 F 0 0 0 0 0 0 0 0 0 0 0 0 -1.0350 0.5110 4.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6610 -0.6980 4.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9040 -1.7950 5.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4880 -1.7040 5.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1290 -0.5130 4.8670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3660 0.5830 4.4470 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4780 -0.2890 4.8970 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2860 -1.3120 5.4650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0940 -2.8400 -0.4770 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -1.1190 -0.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8060 -1.6330 0.7780 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9700 -2.1890 -1.6660 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3900 -2.6540 0.0000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3490 0.4100 -0.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3000 -1.3150 -1.2350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7460 -0.7270 -3.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2410 0.2080 -3.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7670 0.9690 -2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0440 -0.8320 1.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7700 -0.7890 1.2890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7550 1.5540 1.4810 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2790 1.7520 0.6170 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 3.2440 7.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 4.6990 5.8830 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0210 4.9510 7.0060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4810 1.1830 8.9800 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7210 0.8980 7.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.7430 -0.8000 4.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3990 -2.7250 5.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0400 -2.5790 5.5300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8840 1.5060 4.1930 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2580 -2.2190 4.8520 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3200 -0.9520 5.4790 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9920 -1.5230 6.4990 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4900 -0.5620 -0.3920 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.8050 0.1450 -0.6900 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 1 34 1 0 0 0 0 2 35 1 0 0 0 0 2 36 1 0 0 0 0 2 58 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 3 58 1 0 0 0 0 4 39 1 0 0 0 0 4 40 1 0 0 0 0 4 41 1 0 0 0 0 5 6 1 0 0 0 0 5 42 1 0 0 0 0 5 43 1 0 0 0 0 5 58 1 0 0 0 0 6 7 1 0 0 0 0 6 44 1 0 0 0 0 6 45 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 24 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 1 0 0 0 0 11 14 2 0 0 0 0 12 13 2 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 16 46 1 0 0 0 0 17 18 1 0 0 0 0 17 22 2 0 0 0 0 18 19 2 0 0 0 0 18 47 1 0 0 0 0 19 20 1 0 0 0 0 19 48 1 0 0 0 0 20 21 2 0 0 0 0 20 23 1 0 0 0 0 21 22 1 0 0 0 0 21 49 1 0 0 0 0 22 50 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 51 1 0 0 0 0 26 27 1 0 0 0 0 26 52 1 0 0 0 0 27 28 2 0 0 0 0 27 53 1 0 0 0 0 28 29 1 0 0 0 0 28 30 1 0 0 0 0 29 54 1 0 0 0 0 30 31 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 31 57 1 0 0 0 0 58 59 1 0 0 0 0 M CHG 1 58 1 M END