IBS-ZINC02368911 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 0.0260 1.4920 -0.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0120 -0.0380 -0.0220 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4230 -0.4180 -0.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8580 -0.5410 1.1490 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8110 -2.0100 1.1890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.5700 -2.4850 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4170 -1.9820 0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3700 -0.5140 0.1340 N 0 0 0 0 0 0 0 0 0 0 0 0 -2.1890 -0.0140 -0.8800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9470 -0.3600 -2.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7580 0.1340 -3.2070 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.8120 0.9740 -2.8980 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.0580 1.3220 -1.5770 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2500 0.8240 -0.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.0940 2.1480 -1.2750 O 0 0 0 0 0 0 0 0 0 0 0 0 -5.8880 2.6200 -2.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6250 -2.5060 2.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7310 -3.8860 2.4130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5700 -4.3260 3.4460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4910 -5.7950 3.4480 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0880 -6.7860 4.2270 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8140 -8.1020 3.9840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -8.4620 2.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3400 -7.4940 2.1800 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6080 -6.1490 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1640 -4.9910 1.8060 N 0 0 0 0 0 0 0 0 0 0 0 0 0.5430 -4.9580 1.0610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6770 -9.7750 2.7310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.3300 -10.7260 3.5740 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2300 -3.4280 4.1770 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 -2.1410 3.9350 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3240 -1.6820 2.9700 N 0 0 0 0 0 0 0 0 0 0 0 0 1.0570 1.8460 -0.0470 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.8480 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4850 1.8710 0.8430 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8900 -0.2140 1.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -0.1400 2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5800 -3.5750 1.3600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9820 -2.1060 2.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0220 -2.3840 -0.7590 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4480 -2.3090 0.3040 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1240 -1.0150 -2.4490 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5680 -0.1360 -4.2360 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.4430 1.3590 -3.6840 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4430 1.0920 0.4610 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6780 3.2680 -1.9860 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.2590 3.1800 -3.0570 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3320 1.7710 -2.8850 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 -6.5130 5.0210 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2780 -8.8670 4.5890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6630 -7.7800 1.3880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4100 -10.6220 3.4710 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0460 -10.5480 4.6110 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0340 -11.7340 3.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6460 -1.4370 4.5440 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 4 1 0 0 0 0 2 8 1 0 0 0 0 4 5 1 0 0 0 0 4 36 1 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 17 1 0 0 0 0 6 7 1 0 0 0 0 6 38 1 0 0 0 0 6 39 1 0 0 0 0 7 8 1 0 0 0 0 7 40 1 0 0 0 0 7 41 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 14 2 0 0 0 0 10 11 2 0 0 0 0 10 42 1 0 0 0 0 11 12 1 0 0 0 0 11 43 1 0 0 0 0 12 13 2 0 0 0 0 12 44 1 0 0 0 0 13 14 1 0 0 0 0 13 15 1 0 0 0 0 14 45 1 0 0 0 0 15 16 1 0 0 0 0 16 46 1 0 0 0 0 16 47 1 0 0 0 0 16 48 1 0 0 0 0 17 18 1 0 0 0 0 17 32 2 0 0 0 0 18 19 2 0 0 0 0 18 26 1 0 0 0 0 19 20 1 0 0 0 0 19 30 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 49 1 0 0 0 0 22 23 1 0 0 0 0 22 50 1 0 0 0 0 23 24 2 0 0 0 0 23 28 1 0 0 0 0 24 25 1 0 0 0 0 24 51 1 0 0 0 0 25 26 1 0 0 0 0 26 27 1 0 0 0 0 28 29 1 0 0 0 0 29 52 1 0 0 0 0 29 53 1 0 0 0 0 29 54 1 0 0 0 0 30 31 2 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 M END