IFLAB-ZINC04280074 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 49 0 0 1 0 0 0 0 0999 V2000 0.2520 1.3750 0.7660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2700 -0.0060 0.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2150 -0.6800 -0.0070 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1390 0.0370 -0.7570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1150 1.4180 -0.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1730 2.0860 0.0190 C 0 0 0 0 0 0 0 0 0 0 0 0 3.0990 2.1830 -1.5390 N 0 3 0 0 0 0 0 0 0 0 0 0 3.9290 1.5950 -2.2090 O 0 0 0 0 0 0 0 0 0 0 0 0 3.0780 3.4010 -1.5260 O 0 5 0 0 0 0 0 0 0 0 0 0 1.2370 -2.0790 -0.0200 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0860 -2.7720 0.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9760 -2.1860 0.1020 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 -4.2750 0.1950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3100 -4.8100 0.3070 C 0 0 3 0 0 0 0 0 0 0 0 0 -1.9020 -4.4460 -0.5330 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2860 -6.3170 0.2890 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7230 -6.9390 1.2280 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.3740 -4.3040 1.4680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.9610 -3.8160 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.0130 -3.0920 3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.5330 -3.0200 3.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 -8.0520 -4.3420 3.5170 O 0 0 0 0 0 0 0 0 0 0 0 0 -7.5020 -5.0370 2.3940 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.9820 -5.1290 2.5520 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4860 1.9000 1.3550 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4490 -0.5620 1.3390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.8750 -0.4840 -1.3500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 3.1660 0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.0800 -2.5500 -0.1080 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5940 -4.6920 -0.6940 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -4.5650 1.0790 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7520 -5.3040 1.2490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6670 -3.6230 0.6680 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6690 -4.4980 3.5930 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5840 -2.8170 3.0120 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.6070 -2.0840 3.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7750 -3.6470 4.7650 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9780 -2.5650 4.5710 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7720 -2.4200 2.8080 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.9240 -6.0400 2.3440 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.7400 -4.4950 1.4780 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.7430 -5.7170 3.4390 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.5530 -5.6080 1.6720 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7790 -6.9670 -0.7700 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.9090 -4.3450 1.5650 N 0 0 0 0 0 0 0 0 0 0 0 0 -1.6140 -4.9200 2.3400 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4260 -3.7760 2.6960 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7850 -7.9330 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 6 2 0 0 0 0 1 25 1 0 0 0 0 2 3 2 0 0 0 0 2 26 1 0 0 0 0 3 4 1 0 0 0 0 3 10 1 0 0 0 0 4 5 2 0 0 0 0 4 27 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 28 1 0 0 0 0 7 8 2 0 0 0 0 7 9 1 0 0 0 0 10 11 1 0 0 0 0 10 29 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 13 30 1 0 0 0 0 13 31 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 14 45 1 0 0 0 0 16 17 2 0 0 0 0 16 44 1 0 0 0 0 18 19 1 0 0 0 0 18 32 1 0 0 0 0 18 33 1 0 0 0 0 18 45 1 0 0 0 0 19 34 1 0 0 0 0 19 35 1 0 0 0 0 19 47 1 0 0 0 0 20 21 1 0 0 0 0 20 36 1 0 0 0 0 20 37 1 0 0 0 0 20 47 1 0 0 0 0 21 22 1 0 0 0 0 21 38 1 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 23 24 1 0 0 0 0 23 40 1 0 0 0 0 23 41 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 24 47 1 0 0 0 0 44 48 1 0 0 0 0 45 46 1 0 0 0 0 M CHG 1 7 1 M CHG 1 9 -1 M END