IBS-ZINC02408091 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 58 0 0 1 0 0 0 0 0999 V2000 0.6180 -0.1940 1.3870 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0260 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3880 -0.6420 -0.0330 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9890 -0.2120 0.7680 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2850 -2.1330 0.1620 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9080 -2.7340 1.2390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8130 -4.1020 1.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 -4.8680 0.5190 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4720 -4.2660 -0.5590 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.5710 -2.9000 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0400 -0.3530 -1.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4520 -1.2650 -2.0450 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 0.9200 -1.7860 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.6700 1.1800 -3.0490 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.0220 0.1610 -3.8200 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.5100 0.3660 -5.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.6470 1.6840 -5.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2610 2.7340 -4.6430 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7890 2.4410 -3.4430 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.3710 4.1690 -5.0740 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4030 4.3330 -6.1870 C 0 0 3 0 0 0 0 0 0 0 0 0 -5.3950 4.0960 -5.8010 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0650 3.3830 -7.3430 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.1920 1.9660 -6.8200 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7230 1.0970 -7.4780 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.3840 5.7550 -6.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5260 6.5310 -6.6020 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.5080 7.8360 -7.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3500 8.3650 -7.5960 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2090 7.5890 -7.6770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2250 6.2860 -7.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3320 9.7870 -8.0940 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6460 0.1670 1.3830 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0350 0.3780 2.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -1.2480 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0540 1.0350 -0.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6430 -0.5280 -0.7410 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4690 -2.1350 1.9420 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3000 -4.5710 2.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -5.9360 0.6590 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -4.8650 -1.2610 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -2.4300 -1.5840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 1.6530 -1.2080 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7960 -0.4650 -5.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6680 4.7770 -4.2190 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4000 4.5100 -5.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7630 3.5370 -8.1660 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0450 3.5620 -7.6830 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4310 6.1180 -6.1820 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4000 8.4420 -6.9950 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3040 8.0020 -8.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 5.6810 -7.2770 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0420 10.4530 -7.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6150 9.8770 -8.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3250 10.0600 -8.4510 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 2 36 1 0 0 0 0 2 37 1 0 0 0 0 3 4 1 0 0 0 0 3 5 1 0 0 0 0 3 11 1 0 0 0 0 5 6 1 0 0 0 0 5 10 2 0 0 0 0 6 7 2 0 0 0 0 6 38 1 0 0 0 0 7 8 1 0 0 0 0 7 39 1 0 0 0 0 8 9 2 0 0 0 0 8 40 1 0 0 0 0 9 10 1 0 0 0 0 9 41 1 0 0 0 0 10 42 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 43 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 16 17 1 0 0 0 0 16 44 1 0 0 0 0 17 18 2 0 0 0 0 17 24 1 0 0 0 0 18 19 1 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 20 45 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 2 0 0 0 0 26 27 1 0 0 0 0 26 31 2 0 0 0 0 27 28 2 0 0 0 0 27 49 1 0 0 0 0 28 29 1 0 0 0 0 28 50 1 0 0 0 0 29 30 2 0 0 0 0 29 32 1 0 0 0 0 30 31 1 0 0 0 0 30 51 1 0 0 0 0 31 52 1 0 0 0 0 32 53 1 0 0 0 0 32 54 1 0 0 0 0 32 55 1 0 0 0 0 M END