IFLAB-ZINC04163446 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 46 0 0 1 0 0 0 0 0999 V2000 2.7360 1.3370 2.5080 C 0 0 0 0 0 0 0 0 0 0 0 0 2.3200 2.3070 1.4330 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0170 2.5520 1.0420 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 3.5650 -0.0290 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1460 4.2140 -0.8150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5540 5.1360 -1.7550 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9030 5.4170 -1.9180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8510 4.7810 -1.1460 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4580 3.8470 -0.1920 C 0 0 0 0 0 0 0 0 0 0 0 0 3.1580 3.0720 0.7110 N 0 0 0 0 0 0 0 0 0 0 0 0 4.1230 3.0760 0.8090 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1930 1.9320 1.5800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.2750 2.1800 1.0840 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.1000 0.9950 2.7360 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1580 -0.1760 2.5490 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.3020 1.4480 3.9890 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.4940 2.8830 4.2440 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.5590 3.4170 3.2960 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7940 3.0740 5.0320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7520 2.2110 6.2950 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6370 0.7360 5.9040 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3410 0.5180 5.1260 C 0 0 3 0 0 0 0 0 0 0 0 0 0.5110 0.7040 5.7800 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2900 -0.9220 4.6110 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6850 3.4220 5.0570 C 0 0 0 0 0 0 0 0 0 0 0 0 2.8030 0.3340 2.0870 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7080 1.6300 2.9050 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9990 1.3460 3.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9050 3.9960 -0.6890 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1780 5.6410 -2.3660 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2130 6.1400 -2.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8980 5.0070 -1.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9000 4.1220 5.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6410 2.7740 4.4140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8910 2.4940 6.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.6660 2.3640 6.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.6310 0.1200 6.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.4850 0.4580 5.2780 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6860 -1.1140 4.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4510 -1.6110 5.4400 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0680 -1.0680 3.8610 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6090 3.2740 4.4980 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5400 4.4860 5.2450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7450 2.8900 6.0060 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 2 0 0 0 0 2 10 1 0 0 0 0 3 4 1 0 0 0 0 3 12 1 0 0 0 0 4 5 1 0 0 0 0 4 9 2 0 0 0 0 5 6 2 0 0 0 0 5 29 1 0 0 0 0 6 7 1 0 0 0 0 6 30 1 0 0 0 0 7 8 2 0 0 0 0 7 31 1 0 0 0 0 8 9 1 0 0 0 0 8 32 1 0 0 0 0 9 10 1 0 0 0 0 10 11 1 0 0 0 0 12 13 2 0 0 0 0 12 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 16 17 1 0 0 0 0 16 22 1 0 0 0 0 17 18 1 0 0 0 0 17 19 1 0 0 0 0 17 25 1 0 0 0 0 19 20 1 0 0 0 0 19 33 1 0 0 0 0 19 34 1 0 0 0 0 20 21 1 0 0 0 0 20 35 1 0 0 0 0 20 36 1 0 0 0 0 21 22 1 0 0 0 0 21 37 1 0 0 0 0 21 38 1 0 0 0 0 22 23 1 0 0 0 0 22 24 1 0 0 0 0 24 39 1 0 0 0 0 24 40 1 0 0 0 0 24 41 1 0 0 0 0 25 42 1 0 0 0 0 25 43 1 0 0 0 0 25 44 1 0 0 0 0 M END