IFLAB-ZINC04247652 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 54 0 0 1 0 0 0 0 0999 V2000 -1.3020 -2.4710 -1.3760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1820 -2.2070 -1.1230 C 0 0 3 0 0 0 0 0 0 0 0 0 0.7910 -2.6640 -1.9110 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5710 -2.7860 0.2410 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0300 -2.5270 0.5710 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3270 -1.0390 0.5270 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9720 -0.4170 -0.8310 C 0 0 3 0 0 0 0 0 0 0 0 0 2.5640 -0.8950 -1.6180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0590 0.0460 -2.3700 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5120 -0.4390 -3.7160 C 0 0 3 0 0 0 0 0 0 0 0 0 0.4400 -1.5280 -3.7920 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2580 0.2320 -4.8660 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0340 -0.3820 -6.1560 N 0 0 0 0 0 0 0 0 0 0 0 0 0.8740 0.1550 -7.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9330 -0.7050 -8.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0800 -1.8150 -7.8650 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4840 -1.5780 -6.6050 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3930 -2.4730 -6.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7220 -3.6380 -6.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.1690 -3.9040 -7.9550 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2730 -3.0040 -8.5420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7320 -0.4450 -9.3560 C 0 0 0 0 0 0 0 0 0 0 0 0 1.7700 -1.3040 -10.3210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.6120 -0.8150 -11.3260 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8950 -0.0880 -3.8070 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2510 -0.4740 -4.6300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2520 1.0860 -0.7670 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9360 -1.8910 -0.6970 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5880 -2.2330 -2.4050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5350 -3.5310 -1.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0630 -2.3580 1.0280 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3930 -3.8690 0.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2610 -2.9220 1.5670 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6740 -3.0570 -0.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7720 -0.5340 1.3290 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3920 -0.8840 0.7370 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 1.1100 -2.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1470 -0.0670 -2.3350 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3430 0.1610 -4.7230 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0040 1.2940 -4.9440 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3640 1.1060 -6.9250 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8390 -2.2760 -5.0440 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4230 -4.3450 -6.2710 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4360 -4.8160 -8.4840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1440 -3.2240 -9.5210 H 0 0 0 0 0 0 0 0 0 0 0 0 2.3020 0.5000 -9.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5730 -1.5260 -11.9900 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2650 1.2720 -0.3920 H 0 0 0 0 0 0 0 0 0 0 0 0 2.1980 1.5580 -1.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5500 1.5970 -0.1000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4870 -0.6990 -1.1370 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.0320 -0.3010 -0.3420 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 28 1 0 0 0 0 1 29 1 0 0 0 0 1 30 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 51 1 0 0 0 0 4 5 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 33 1 0 0 0 0 5 34 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 6 36 1 0 0 0 0 7 8 1 0 0 0 0 7 27 1 0 0 0 0 7 51 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 9 38 1 0 0 0 0 9 51 1 0 0 0 0 10 11 1 0 0 0 0 10 12 1 0 0 0 0 10 25 1 0 0 0 0 12 13 1 0 0 0 0 12 39 1 0 0 0 0 12 40 1 0 0 0 0 13 14 1 0 0 0 0 13 17 1 0 0 0 0 14 15 2 0 0 0 0 14 41 1 0 0 0 0 15 16 1 0 0 0 0 15 22 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 18 19 1 0 0 0 0 18 42 1 0 0 0 0 19 20 2 0 0 0 0 19 43 1 0 0 0 0 20 21 1 0 0 0 0 20 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 2 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 27 48 1 0 0 0 0 27 49 1 0 0 0 0 27 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END