IFLAB-ZINC04275278 MOE2007 3D CORINA 3.40 0006 02.08.2006 48 50 0 0 0 0 0 0 0 0999 V2000 0.1990 1.5150 0.2030 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0130 -0.0090 0.1240 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6360 -0.6780 1.3740 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8480 -2.1590 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9830 -3.1520 2.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1210 -4.4230 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1450 -4.4120 0.0170 S 0 0 0 0 0 0 0 0 0 0 0 0 0.9660 -2.7210 -0.0580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9320 -1.9690 -1.3710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2070 -2.4330 -2.2930 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2740 -2.1060 -2.1190 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2380 -5.6030 2.4290 N 0 0 0 0 0 0 0 0 0 0 0 0 1.3880 -6.8790 1.9300 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4760 -7.2420 0.7660 O 0 0 0 0 0 0 0 0 0 0 0 0 1.4830 -7.9030 3.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5530 -9.0930 2.9860 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3980 -8.0480 4.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9870 -2.9570 3.7090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.9970 -3.9000 4.4950 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0050 -1.6470 4.0810 O 0 0 0 0 0 0 0 0 0 0 0 0 1.0280 -1.4280 5.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4820 -0.3190 -0.0170 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2580 1.7890 0.2650 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2230 2.0150 -0.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3000 1.9240 1.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6110 -0.2260 1.5980 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0210 -0.4820 2.2290 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1800 -2.4250 -1.7960 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2810 -1.8020 -3.1860 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0430 -3.4590 -2.6420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4620 -3.1400 -2.4290 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2890 -1.4880 -3.0240 H 0 0 0 0 0 0 0 0 0 0 0 0 3.1180 -1.7980 -1.4890 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2050 -5.4890 3.4450 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5030 -8.1080 3.3210 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1980 -9.1440 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9590 -10.0570 3.2730 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -8.3080 5.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4770 -7.4100 3.9960 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9330 -1.8590 5.9330 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0370 -0.3490 5.6690 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -1.8490 5.9610 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8790 0.0430 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6980 -1.3880 0.0600 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.0530 0.1690 0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7560 -0.4620 -1.1270 N 0 3 0 0 0 0 0 0 0 0 0 0 0.3320 -0.0300 -1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7000 -0.0550 -1.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 23 1 0 0 0 0 1 24 1 0 0 0 0 1 25 1 0 0 0 0 2 3 1 0 0 0 0 2 22 1 0 0 0 0 2 46 1 0 0 0 0 3 4 1 0 0 0 0 3 26 1 0 0 0 0 3 27 1 0 0 0 0 4 5 1 0 0 0 0 4 8 2 0 0 0 0 5 6 2 0 0 0 0 5 18 1 0 0 0 0 6 7 1 0 0 0 0 6 12 1 0 0 0 0 7 8 1 0 0 0 0 8 9 1 0 0 0 0 9 10 1 0 0 0 0 9 11 1 0 0 0 0 9 46 1 0 0 0 0 10 28 1 0 0 0 0 10 29 1 0 0 0 0 10 30 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 11 33 1 0 0 0 0 12 13 1 0 0 0 0 12 34 1 0 0 0 0 13 14 2 0 0 0 0 13 15 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 16 36 1 0 0 0 0 16 37 1 0 0 0 0 17 38 1 0 0 0 0 17 39 1 0 0 0 0 18 19 2 0 0 0 0 18 20 1 0 0 0 0 20 21 1 0 0 0 0 21 40 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 22 45 1 0 0 0 0 46 47 1 0 0 0 0 46 48 1 0 0 0 0 M CHG 1 46 1 M END