IFLAB-ZINC03865508 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 -0.2210 2.1570 0.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2780 0.6350 0.5090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4860 0.0160 1.5780 O 0 0 0 0 0 0 0 0 0 0 0 0 0.5370 -1.3290 1.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0410 -1.9680 0.7360 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2290 -1.9660 2.5570 N 0 0 0 0 0 0 0 0 0 0 0 0 1.2980 -3.4350 2.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9110 -3.9080 3.9980 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5300 -1.7670 4.9680 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9400 -1.2120 3.6000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5320 -3.7720 6.3340 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2380 -5.1240 6.4540 C 0 0 3 0 0 0 0 0 0 0 0 0 1.8400 -5.8090 5.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 -5.7020 7.8500 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5580 -7.0150 7.9250 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4330 -7.6730 9.1070 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7840 -7.0680 10.1740 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6570 -7.7390 11.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1760 -9.0140 11.5130 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8220 -9.6190 10.4520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.9470 -8.9540 9.2470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.6350 -9.6050 8.1100 N 0 3 0 0 0 0 0 0 0 0 0 0 4.0860 -10.7290 8.2330 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7490 -9.0160 7.0490 O 0 5 0 0 0 0 0 0 0 0 0 0 3.6400 -4.9500 6.2430 O 0 0 0 0 0 0 0 0 0 0 0 0 0.8160 2.4890 0.6020 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7940 2.6220 -0.1460 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6440 2.4450 1.6190 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3150 0.3030 0.5640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1450 0.3480 -0.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6040 -3.8520 1.8620 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3130 -3.7600 2.3630 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1370 -3.6730 4.1850 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0620 -4.9840 4.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1280 -1.2950 5.7470 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4740 -1.5580 5.1440 H 0 0 0 0 0 0 0 0 0 0 0 0 3.0160 -1.3260 3.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6710 -0.1570 3.5370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4630 -3.9030 6.5030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9360 -3.0850 7.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4740 -5.0620 8.5940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9280 -5.7520 8.0450 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3790 -6.0720 10.0660 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1520 -7.2680 12.2050 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0760 -9.5370 12.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2270 -10.6140 10.5630 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0610 -4.3520 6.8750 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7510 -3.2230 4.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 28 1 0 0 0 0 2 3 1 0 0 0 0 2 29 1 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 6 7 1 0 0 0 0 6 10 1 0 0 0 0 7 8 1 0 0 0 0 7 31 1 0 0 0 0 7 32 1 0 0 0 0 8 33 1 0 0 0 0 8 34 1 0 0 0 0 8 48 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 9 36 1 0 0 0 0 9 48 1 0 0 0 0 10 37 1 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 39 1 0 0 0 0 11 40 1 0 0 0 0 11 48 1 0 0 0 0 12 13 1 0 0 0 0 12 14 1 0 0 0 0 12 25 1 0 0 0 0 14 15 1 0 0 0 0 14 41 1 0 0 0 0 14 42 1 0 0 0 0 15 16 1 0 0 0 0 16 17 1 0 0 0 0 16 21 2 0 0 0 0 17 18 2 0 0 0 0 17 43 1 0 0 0 0 18 19 1 0 0 0 0 18 44 1 0 0 0 0 19 20 2 0 0 0 0 19 45 1 0 0 0 0 20 21 1 0 0 0 0 20 46 1 0 0 0 0 21 22 1 0 0 0 0 22 23 2 0 0 0 0 22 24 1 0 0 0 0 25 47 1 0 0 0 0 M CHG 1 22 1 M CHG 1 24 -1 M END