IBS-ZINC05141854 MOE2007 3D CORINA 3.40 0006 02.08.2006 58 60 0 0 1 0 0 0 0 0999 V2000 0.4580 2.3250 -2.0220 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3280 1.3480 -0.8520 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1310 1.2920 -0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7460 0.0470 -1.2700 O 0 0 0 0 0 0 0 0 0 0 0 0 2.0780 -0.2090 -1.2490 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9600 0.7510 -0.7650 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3120 0.4960 -0.7400 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8000 -0.7320 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9070 -1.6950 -1.6900 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5560 -1.4330 -1.7050 C 0 0 0 0 0 0 0 0 0 0 0 0 6.2440 -1.0100 -1.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8790 -1.3800 -2.3130 O 0 0 0 0 0 0 0 0 0 0 0 0 6.9510 -0.8910 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 6.4370 -0.5480 1.2600 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5600 -0.5440 2.2350 C 0 0 0 0 0 0 0 0 0 0 0 0 7.4550 -0.2870 3.4170 O 0 0 0 0 0 0 0 0 0 0 0 0 8.7090 -0.8660 1.6160 N 0 0 0 0 0 0 0 0 0 0 0 0 8.4330 -1.1120 0.1980 C 0 0 3 0 0 0 0 0 0 0 0 0 8.9990 -0.4130 -0.4170 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7960 -2.5290 -0.1630 C 0 0 0 0 0 0 0 0 0 0 0 0 9.3870 -2.8020 -1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7200 -4.1020 -1.7140 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4630 -5.1290 -0.8260 C 0 0 0 0 0 0 0 0 0 0 0 0 8.8730 -4.8560 0.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 8.5440 -3.5560 0.7270 C 0 0 0 0 0 0 0 0 0 0 0 0 10.0230 -0.9620 2.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2420 -2.3900 2.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 11.6100 -1.6710 4.6260 C 0 0 0 0 0 0 0 0 0 0 0 0 11.9050 -3.8840 3.6880 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2720 -0.2970 1.5120 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 2.3650 -2.3480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 1.9900 -2.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 3.3180 -1.7030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9560 1.6830 -0.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7580 0.9570 -1.2200 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2240 0.5960 0.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4490 2.2850 -0.0750 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5840 1.6980 -0.4080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 1.2420 -0.3650 H 0 0 0 0 0 0 0 0 0 0 0 0 4.2780 -2.6440 -2.0480 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8670 -2.1770 -2.0760 H 0 0 0 0 0 0 0 0 0 0 0 0 9.5880 -1.9990 -2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1800 -4.3150 -2.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7220 -6.1450 -1.0850 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6720 -5.6590 1.0880 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0860 -3.3420 1.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 10.7990 -0.7090 1.5340 H 0 0 0 0 0 0 0 0 0 0 0 0 10.0690 -0.2680 3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4660 -2.6420 3.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 10.1950 -3.0830 1.9220 H 0 0 0 0 0 0 0 0 0 0 0 0 10.8530 -2.0220 5.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 11.4180 -0.6280 4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 12.5960 -1.7610 5.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 11.9280 -4.4500 2.7570 H 0 0 0 0 0 0 0 0 0 0 0 0 11.1590 -4.3150 4.3560 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8850 -3.9270 4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8260 -1.5400 -2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5590 -2.4860 3.4040 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 34 1 0 0 0 0 3 35 1 0 0 0 0 3 36 1 0 0 0 0 3 37 1 0 0 0 0 4 5 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 11 1 0 0 0 0 9 10 1 0 0 0 0 9 40 1 0 0 0 0 10 41 1 0 0 0 0 11 12 1 0 0 0 0 11 13 2 0 0 0 0 12 57 1 0 0 0 0 13 14 1 0 0 0 0 13 18 1 0 0 0 0 14 15 1 0 0 0 0 14 30 2 0 0 0 0 15 16 2 0 0 0 0 15 17 1 0 0 0 0 17 18 1 0 0 0 0 17 26 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 25 2 0 0 0 0 21 22 2 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 23 24 2 0 0 0 0 23 44 1 0 0 0 0 24 25 1 0 0 0 0 24 45 1 0 0 0 0 25 46 1 0 0 0 0 26 27 1 0 0 0 0 26 47 1 0 0 0 0 26 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 27 58 1 0 0 0 0 28 51 1 0 0 0 0 28 52 1 0 0 0 0 28 53 1 0 0 0 0 28 58 1 0 0 0 0 29 54 1 0 0 0 0 29 55 1 0 0 0 0 29 56 1 0 0 0 0 29 58 1 0 0 0 0 M END