IBS-ZINC02223928 MOE2007 3D CORINA 3.40 0006 02.08.2006 61 64 0 0 1 0 0 0 0 0999 V2000 5.3940 0.9080 2.3720 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0520 0.3950 3.7470 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0320 -0.5210 3.9060 C 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -0.9960 5.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4370 -0.5400 6.2870 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4580 0.3800 6.1120 C 0 0 0 0 0 0 0 0 0 0 0 0 5.7670 0.8400 4.8460 C 0 0 0 0 0 0 0 0 0 0 0 0 6.8830 1.8350 4.6610 C 0 0 0 0 0 0 0 0 0 0 0 0 4.1360 -0.9960 7.5310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6230 -1.9780 5.3540 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6220 -3.0540 6.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3700 -3.6790 6.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7150 -2.9790 5.1020 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4200 -1.9800 4.7100 N 0 0 0 0 0 0 0 0 0 0 0 0 1.1410 -1.3250 4.0520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8850 -4.8930 6.6950 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5890 -5.4500 7.5150 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3390 -5.3820 6.4140 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7600 -6.5860 6.9900 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3740 -6.9110 8.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7910 -8.1000 8.8490 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5910 -8.9670 8.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9770 -8.6470 6.8390 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.5680 -7.4560 6.2700 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1210 -10.4830 8.8530 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.4160 -11.3610 7.7760 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.1790 -10.7910 9.8720 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.5580 -10.1840 9.6200 N 0 0 0 0 0 0 0 0 0 0 0 0 -4.8360 -10.4760 8.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.6750 -11.3710 9.8730 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.8160 -10.7020 11.2420 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4330 -10.5270 11.8720 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.5790 -9.6270 10.9790 C 0 0 3 0 0 0 0 0 0 0 0 0 -4.0090 -8.6260 10.9580 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -9.5650 11.5310 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8050 1.8000 2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4550 1.1540 2.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1690 0.1400 1.6320 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4800 -0.8690 3.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0160 0.7350 6.9660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.4840 2.8460 4.7380 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6380 1.6820 5.4330 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3350 1.6960 3.6790 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6250 -1.7890 7.7880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.4110 -3.3610 6.8670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 -4.9000 5.8130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2510 -6.2340 8.8480 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4910 -8.3530 9.8550 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6020 -9.3260 6.2790 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8740 -7.2040 5.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.3700 -9.5450 8.7660 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6480 -10.9910 8.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6620 -11.5160 9.4350 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.1820 -12.3360 9.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2870 -9.7260 11.1220 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.4340 -11.3250 11.8890 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.5360 -10.0710 12.8570 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9520 -11.5000 11.9690 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5120 -9.0420 10.8220 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1540 -9.0320 12.4820 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7780 -10.5770 11.6820 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 36 1 0 0 0 0 1 37 1 0 0 0 0 1 38 1 0 0 0 0 2 3 1 0 0 0 0 2 7 2 0 0 0 0 3 4 2 0 0 0 0 3 39 1 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 2 0 0 0 0 5 9 1 0 0 0 0 6 7 1 0 0 0 0 6 40 1 0 0 0 0 7 8 1 0 0 0 0 8 41 1 0 0 0 0 8 42 1 0 0 0 0 8 43 1 0 0 0 0 9 44 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 11 45 1 0 0 0 0 12 13 2 0 0 0 0 12 16 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 46 1 0 0 0 0 19 20 1 0 0 0 0 19 24 2 0 0 0 0 20 21 2 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 48 1 0 0 0 0 22 23 2 0 0 0 0 22 25 1 0 0 0 0 23 24 1 0 0 0 0 23 49 1 0 0 0 0 24 50 1 0 0 0 0 25 26 2 0 0 0 0 25 27 2 0 0 0 0 25 28 1 0 0 0 0 28 29 1 0 0 0 0 28 33 1 0 0 0 0 29 30 1 0 0 0 0 29 51 1 0 0 0 0 29 52 1 0 0 0 0 30 31 1 0 0 0 0 30 53 1 0 0 0 0 30 54 1 0 0 0 0 31 32 1 0 0 0 0 31 55 1 0 0 0 0 31 56 1 0 0 0 0 32 33 1 0 0 0 0 32 57 1 0 0 0 0 32 58 1 0 0 0 0 33 34 1 0 0 0 0 33 35 1 0 0 0 0 35 59 1 0 0 0 0 35 60 1 0 0 0 0 35 61 1 0 0 0 0 M END