IFLAB-ZINC04315168 MOE2007 3D CORINA 3.40 0006 02.08.2006 52 55 0 0 1 0 0 0 0 0999 V2000 0.1340 1.1050 -1.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3560 -0.2380 -1.8820 C 0 0 0 0 0 0 0 0 0 0 0 0 1.6150 -0.8220 -1.6860 C 0 0 0 0 0 0 0 0 0 0 0 0 2.6510 -0.0300 -1.1660 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4010 1.3030 -0.8620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1560 1.9090 -1.0470 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5980 1.7730 -0.3850 N 0 0 0 0 0 0 0 0 0 0 0 0 3.7670 2.7160 -0.0680 H 0 0 0 0 0 0 0 0 0 0 0 0 4.5110 0.7430 -0.4170 C 0 0 0 0 0 0 0 0 0 0 0 0 3.9550 -0.3570 -0.8850 N 0 0 0 0 0 0 0 0 0 0 0 0 5.9390 0.8680 0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 6.0520 1.2160 1.5160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5090 1.2750 1.9560 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1870 1.9260 -0.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 6.7280 1.8730 -0.8170 C 0 0 0 0 0 0 0 0 0 0 0 0 9.7130 2.4390 1.5630 C 0 0 0 0 0 0 0 0 0 0 0 0 10.2270 3.8270 1.1960 C 0 0 0 0 0 0 0 0 0 0 0 0 9.4320 4.7190 0.8960 O 0 0 0 0 0 0 0 0 0 0 0 0 11.5950 3.9720 1.2360 N 0 0 0 0 0 0 0 0 0 0 0 0 12.2560 5.2310 0.9190 C 0 0 0 0 0 0 0 0 0 0 0 0 12.6200 5.3100 -0.5700 C 0 0 3 0 0 0 0 0 0 0 0 0 11.7340 5.1060 -1.1830 H 0 0 0 0 0 0 0 0 0 0 0 0 13.2450 6.6450 -0.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 14.7220 6.3800 -0.7990 C 0 0 0 0 0 0 0 0 0 0 0 0 14.8280 4.9430 -1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0 13.6100 4.2980 -0.8540 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.8530 1.5340 -1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4570 -0.8390 -2.2840 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7920 -1.8640 -1.9300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9810 2.9520 -0.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 6.3990 -0.1200 -0.1160 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5700 2.1810 1.7210 H 0 0 0 0 0 0 0 0 0 0 0 0 5.5230 0.4690 2.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 7.5800 1.6240 2.9920 H 0 0 0 0 0 0 0 0 0 0 0 0 8.0040 0.3020 1.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 8.6890 0.9640 -0.5310 H 0 0 0 0 0 0 0 0 0 0 0 0 8.7250 2.7070 -0.9260 H 0 0 0 0 0 0 0 0 0 0 0 0 6.6790 1.5950 -1.8770 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2850 2.8740 -0.7360 H 0 0 0 0 0 0 0 0 0 0 0 0 10.3200 1.6450 1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0 9.7230 2.3550 2.6540 H 0 0 0 0 0 0 0 0 0 0 0 0 12.2000 3.1920 1.4700 H 0 0 0 0 0 0 0 0 0 0 0 0 11.5970 6.0600 1.1990 H 0 0 0 0 0 0 0 0 0 0 0 0 13.1550 5.2690 1.5440 H 0 0 0 0 0 0 0 0 0 0 0 0 13.0250 6.8620 -2.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 12.8880 7.4900 -0.3570 H 0 0 0 0 0 0 0 0 0 0 0 0 15.3520 7.0590 -1.3800 H 0 0 0 0 0 0 0 0 0 0 0 0 15.0090 6.4630 0.2560 H 0 0 0 0 0 0 0 0 0 0 0 0 14.9000 4.8760 -2.3460 H 0 0 0 0 0 0 0 0 0 0 0 0 15.6830 4.4220 -0.8150 H 0 0 0 0 0 0 0 0 0 0 0 0 8.2650 2.2540 1.0950 N 0 3 0 0 0 0 0 0 0 0 0 0 7.8480 3.1950 1.2120 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 27 1 0 0 0 0 2 3 2 0 0 0 0 2 28 1 0 0 0 0 3 4 1 0 0 0 0 3 29 1 0 0 0 0 4 5 2 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 1 0 0 0 0 7 9 1 0 0 0 0 9 10 2 0 0 0 0 9 11 1 0 0 0 0 11 12 1 0 0 0 0 11 15 1 0 0 0 0 11 31 1 0 0 0 0 12 13 1 0 0 0 0 12 32 1 0 0 0 0 12 33 1 0 0 0 0 13 34 1 0 0 0 0 13 35 1 0 0 0 0 13 51 1 0 0 0 0 14 15 1 0 0 0 0 14 36 1 0 0 0 0 14 37 1 0 0 0 0 14 51 1 0 0 0 0 15 38 1 0 0 0 0 15 39 1 0 0 0 0 16 17 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 51 1 0 0 0 0 17 18 2 0 0 0 0 17 19 1 0 0 0 0 19 20 1 0 0 0 0 19 42 1 0 0 0 0 20 21 1 0 0 0 0 20 43 1 0 0 0 0 20 44 1 0 0 0 0 21 22 1 0 0 0 0 21 23 1 0 0 0 0 21 26 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 25 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 25 26 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 51 52 1 0 0 0 0 M CHG 1 51 1 M END