IFLAB-ZINC04318097 MOE2007 3D CORINA 3.40 0006 02.08.2006 46 47 0 0 1 0 0 0 0 0999 V2000 -1.7780 0.1420 0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2750 -0.1320 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -0.5830 -0.9400 N 0 0 0 0 0 0 0 0 0 0 0 0 1.4340 -1.0210 -1.0630 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3150 -1.2640 -0.0410 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5320 -1.7090 -0.3020 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3490 -1.9400 0.5640 O 0 0 0 0 0 0 0 0 0 0 0 0 3.8190 -1.9060 -1.7730 C 0 0 3 0 0 0 0 0 0 0 0 0 4.0450 -2.9510 -1.9830 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2590 -1.4170 -2.5810 S 0 0 0 0 0 0 0 0 0 0 0 0 4.9720 -1.0060 -2.2220 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3170 -1.3100 -3.6570 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7010 -2.1630 -4.2610 O 0 0 0 0 0 0 0 0 0 0 0 0 6.3100 -0.6350 -4.2690 N 0 0 0 0 0 0 0 0 0 0 0 0 6.6450 -0.9310 -5.6640 C 0 0 3 0 0 0 0 0 0 0 0 0 5.7360 -1.1820 -6.2110 H 0 0 0 0 0 0 0 0 0 0 0 0 7.6150 -2.1130 -5.7160 C 0 0 0 0 0 0 0 0 0 0 0 0 7.2910 0.2770 -6.2920 C 0 0 0 0 0 0 0 0 0 0 0 0 6.9800 0.6300 -7.5920 C 0 0 0 0 0 0 0 0 0 0 0 0 7.5720 1.7380 -8.1680 C 0 0 0 0 0 0 0 0 0 0 0 0 8.4760 2.4940 -7.4440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.7870 2.1410 -6.1440 C 0 0 0 0 0 0 0 0 0 0 0 0 8.1910 1.0350 -5.5670 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9060 -1.0300 1.3460 C 0 0 0 0 0 0 0 0 0 0 0 0 1.1660 -2.2600 1.8740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.9650 0.9150 -0.4650 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2980 -0.7720 -0.0050 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1420 0.4780 1.2520 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2450 0.7830 0.6520 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0880 -0.9040 1.1110 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6740 0.0380 -2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8430 -1.1900 -1.5920 H 0 0 0 0 0 0 0 0 0 0 0 0 6.8030 0.0460 -3.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 8.5240 -1.8610 -5.1690 H 0 0 0 0 0 0 0 0 0 0 0 0 7.1480 -2.9870 -5.2620 H 0 0 0 0 0 0 0 0 0 0 0 0 7.8650 -2.3330 -6.7540 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2730 0.0400 -8.1570 H 0 0 0 0 0 0 0 0 0 0 0 0 7.3290 2.0140 -9.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 8.9400 3.3590 -7.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 9.4940 2.7300 -5.5790 H 0 0 0 0 0 0 0 0 0 0 0 0 8.4320 0.7620 -4.5500 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7890 -0.8460 1.9590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2470 -0.1630 1.3890 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3340 -2.4960 1.2100 H 0 0 0 0 0 0 0 0 0 0 0 0 1.8500 -3.1080 1.9130 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7850 -2.0540 2.8740 H 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 2 0 0 0 0 4 5 1 0 0 0 0 4 10 1 0 0 0 0 5 6 1 0 0 0 0 5 24 1 0 0 0 0 6 7 2 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 10 1 0 0 0 0 8 11 1 0 0 0 0 11 12 1 0 0 0 0 11 31 1 0 0 0 0 11 32 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 1 0 0 0 0 14 33 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 18 1 0 0 0 0 17 34 1 0 0 0 0 17 35 1 0 0 0 0 17 36 1 0 0 0 0 18 19 1 0 0 0 0 18 23 2 0 0 0 0 19 20 2 0 0 0 0 19 37 1 0 0 0 0 20 21 1 0 0 0 0 20 38 1 0 0 0 0 21 22 2 0 0 0 0 21 39 1 0 0 0 0 22 23 1 0 0 0 0 22 40 1 0 0 0 0 23 41 1 0 0 0 0 24 25 1 0 0 0 0 24 42 1 0 0 0 0 24 43 1 0 0 0 0 25 44 1 0 0 0 0 25 45 1 0 0 0 0 25 46 1 0 0 0 0 M END