IBS-ZINC02216168 MOE2007 3D CORINA 3.40 0006 02.08.2006 55 59 0 0 1 0 0 0 0 0999 V2000 -0.2670 2.0250 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0750 0.5360 1.1520 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1630 -0.0110 1.2980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3270 -1.3980 1.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2620 -2.1860 0.9070 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9830 -1.6500 0.7580 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.1770 -0.3000 0.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3830 0.2450 0.7460 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.4570 -0.4980 0.4910 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.3150 -1.8960 0.3600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.0280 -2.4660 0.4930 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8650 -3.6690 0.3860 O 0 0 0 0 0 0 0 0 0 0 0 0 -4.5930 -2.4230 0.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4710 -1.3800 0.0680 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7780 -0.2030 0.3090 N 0 0 0 0 0 0 0 0 0 0 0 0 -5.3680 1.1370 0.3620 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.4700 1.6960 -1.0340 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.6800 1.6710 -1.7020 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.7730 2.1830 -2.9830 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6560 2.7210 -3.5950 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4470 2.7470 -2.9270 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3540 2.2390 -1.6450 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9120 -1.4870 -0.1750 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.4200 -2.5780 -0.3510 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.6740 -0.3750 -0.2050 N 0 0 0 0 0 0 0 0 0 0 0 0 -9.0960 -0.4710 -0.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.7240 0.9230 -0.5060 C 0 0 3 0 0 0 0 0 0 0 0 0 -9.2180 1.5770 -1.2160 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.2220 0.8320 -0.8550 C 0 0 0 0 0 0 0 0 0 0 0 0 -11.9370 1.4260 0.3840 C 0 0 0 0 0 0 0 0 0 0 0 0 -10.8090 2.2660 1.0370 C 0 0 0 0 0 0 0 0 0 0 0 0 -9.6230 1.4690 0.8200 O 0 0 0 0 0 0 0 0 0 0 0 0 0.6920 2.4980 1.4960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6700 2.4240 0.3530 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9620 2.2310 2.0980 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0140 0.6200 1.5090 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3070 -1.8380 1.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3990 -3.2530 0.8120 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8340 -3.4640 -0.0580 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3620 1.0800 0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.7380 1.7880 0.9680 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.5520 1.2500 -1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7180 2.1630 -3.5050 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7290 3.1210 -4.5960 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5740 3.1670 -3.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.4100 2.2620 -1.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2810 0.4880 -0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.2030 -0.8910 -1.5450 H 0 0 0 0 0 0 0 0 0 0 0 0 -9.5980 -1.1160 0.1760 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.4440 1.4240 -1.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -11.5170 -0.2060 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.7710 2.0610 0.0840 H 0 0 0 0 0 0 0 0 0 0 0 0 -12.2720 0.6360 1.0550 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.7160 3.2330 0.5430 H 0 0 0 0 0 0 0 0 0 0 0 0 -10.9960 2.3950 2.1030 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 2 0 0 0 0 2 7 1 0 0 0 0 3 4 1 0 0 0 0 3 36 1 0 0 0 0 4 5 2 0 0 0 0 4 37 1 0 0 0 0 5 6 1 0 0 0 0 5 38 1 0 0 0 0 6 7 1 0 0 0 0 6 11 1 0 0 0 0 7 8 2 0 0 0 0 8 9 1 0 0 0 0 9 10 2 0 0 0 0 9 15 1 0 0 0 0 10 11 1 0 0 0 0 10 13 1 0 0 0 0 11 12 2 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 14 23 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 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 42 1 0 0 0 0 19 20 1 0 0 0 0 19 43 1 0 0 0 0 20 21 2 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 2 0 0 0 0 23 25 1 0 0 0 0 25 26 1 0 0 0 0 25 47 1 0 0 0 0 26 27 1 0 0 0 0 26 48 1 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 29 1 0 0 0 0 27 32 1 0 0 0 0 29 30 1 0 0 0 0 29 50 1 0 0 0 0 29 51 1 0 0 0 0 30 31 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 31 32 1 0 0 0 0 31 54 1 0 0 0 0 31 55 1 0 0 0 0 M END