IBS-ZINC04084632 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 52 0 0 1 0 0 0 0 0999 V2000 -0.0190 1.5260 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0200 -0.3810 0.0100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7180 -0.4980 -1.2570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7420 -0.5110 1.2420 C 0 0 3 0 0 0 0 0 0 0 0 0 1.7650 -0.1340 1.2340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0370 -0.0250 2.4810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7090 -0.7670 3.0850 O 0 0 0 0 0 0 0 0 0 0 0 0 0.2350 1.2340 2.9200 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 1.7070 4.1250 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 3.1590 4.4010 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2600 3.7650 3.5180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8650 3.6920 5.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4690 5.1440 5.8600 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0230 5.2120 6.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2280 4.6050 7.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8330 4.6790 5.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4370 3.2270 4.7310 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4130 6.6420 6.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5790 7.5200 6.3980 O 0 0 0 0 0 0 0 0 0 0 0 0 2.6880 6.9450 6.7770 N 0 0 0 0 0 0 0 0 0 0 0 0 3.0670 8.3350 7.0410 C 0 0 3 0 0 0 0 0 0 0 0 0 2.4900 8.9980 6.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7800 8.6720 8.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.5370 8.5170 6.7620 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2000 7.5810 6.3820 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.9030 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8870 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8770 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7410 -0.1200 -1.2640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7330 -1.5870 -1.2630 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1910 -0.1360 -2.1400 H 0 0 0 0 0 0 0 0 0 0 0 0 0.8310 1.8280 2.4370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5290 1.6460 3.9770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1650 1.0850 4.9730 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9280 3.6430 5.3490 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 3.0850 6.4670 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6740 5.7500 4.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0460 5.5230 6.7040 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6280 5.2850 4.1240 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8960 4.7270 5.2420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6420 2.6200 5.6140 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0130 2.8470 3.8880 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3550 6.2420 6.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3570 8.0100 9.1510 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0620 9.7070 8.7020 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7170 8.5410 8.7070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1750 -2.3540 1.2400 H 0 0 0 0 0 0 0 0 0 0 0 0 5.1090 9.7180 6.9360 O 0 0 0 0 0 0 0 0 0 0 0 0 0.7620 -1.9800 1.2340 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2860 -2.3300 0.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 6.0550 9.7860 6.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 5 1 0 0 0 0 4 30 1 0 0 0 0 4 31 1 0 0 0 0 4 32 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 50 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 9 10 1 0 0 0 0 9 33 1 0 0 0 0 10 11 1 0 0 0 0 10 34 1 0 0 0 0 10 35 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 11 18 1 0 0 0 0 13 14 1 0 0 0 0 13 36 1 0 0 0 0 13 37 1 0 0 0 0 14 15 1 0 0 0 0 14 38 1 0 0 0 0 14 39 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 19 1 0 0 0 0 17 18 1 0 0 0 0 17 40 1 0 0 0 0 17 41 1 0 0 0 0 18 42 1 0 0 0 0 18 43 1 0 0 0 0 19 20 2 0 0 0 0 19 21 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 22 25 1 0 0 0 0 24 45 1 0 0 0 0 24 46 1 0 0 0 0 24 47 1 0 0 0 0 25 26 2 0 0 0 0 25 49 1 0 0 0 0 48 50 1 0 0 0 0 49 52 1 0 0 0 0 50 51 1 0 0 0 0 M END