IBS-ZINC06764658 MOE2007 3D CORINA 3.40 0006 02.08.2006 51 53 0 0 0 0 0 0 0 0999 V2000 -0.6760 1.3920 0.0350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2740 -0.0560 0.0450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -0.7320 1.2190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3680 -2.0670 1.0780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4360 -2.6870 -0.1220 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1400 -1.9540 -1.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2180 -0.6580 -1.1660 N 0 0 0 0 0 0 0 0 0 0 0 0 0.2090 -2.6090 -2.5330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6300 -3.9430 -2.6760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6940 -4.5580 -3.9340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.3410 -3.8590 -5.0890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0790 -2.5370 -4.9740 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1420 -1.9240 -3.7130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4490 -4.5760 -6.2490 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1030 -3.9070 -7.4570 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7810 -3.0750 2.5070 S 0 0 0 0 0 0 0 0 0 0 0 0 0.5350 -4.7430 1.8190 C 0 0 0 0 0 0 0 0 0 0 0 0 0.6520 -5.7670 2.9450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -8.0790 3.6340 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4610 -9.4350 3.1280 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5500 -10.0640 2.1780 C 0 0 0 0 0 0 0 0 0 0 0 0 0.8910 -9.1160 1.0360 C 0 0 0 0 0 0 0 0 0 0 0 0 1.3560 -7.7590 1.5460 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0560 -0.0910 2.4950 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1240 0.4270 3.5310 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1190 2.0130 0.4600 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8580 1.7370 -0.9890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5990 1.5370 0.6050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9210 -4.5240 -1.8030 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0260 -5.5900 -4.0110 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3640 -1.9480 -5.8410 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4760 -0.8880 -3.6620 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.9500 -3.6060 -7.4530 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7600 -3.0500 -7.6350 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2440 -4.6130 -8.2810 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4580 -4.8050 1.3590 H 0 0 0 0 0 0 0 0 0 0 0 0 1.2920 -4.9200 1.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6620 -5.8140 3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0610 -5.5310 3.7430 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.7770 -7.6060 4.2320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9260 -8.1590 4.2280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6330 -10.1050 3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4240 -9.3230 2.6130 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4640 -10.3160 2.7300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1500 -11.0020 1.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6730 -9.5600 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0090 -8.9840 0.3960 H 0 0 0 0 0 0 0 0 0 0 0 0 2.2870 -7.8350 2.1190 H 0 0 0 0 0 0 0 0 0 0 0 0 1.4980 -7.0760 0.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3010 -7.1680 2.4590 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.5740 -7.0990 1.9180 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 7 2 0 0 0 0 3 4 2 0 0 0 0 3 24 1 0 0 0 0 4 5 1 0 0 0 0 4 16 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 29 1 0 0 0 0 10 11 1 0 0 0 0 10 30 1 0 0 0 0 11 12 2 0 0 0 0 11 14 1 0 0 0 0 12 13 1 0 0 0 0 12 31 1 0 0 0 0 13 32 1 0 0 0 0 14 15 1 0 0 0 0 15 33 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 1 0 0 0 0 17 18 1 0 0 0 0 17 36 1 0 0 0 0 17 37 1 0 0 0 0 18 38 1 0 0 0 0 18 39 1 0 0 0 0 18 50 1 0 0 0 0 19 20 1 0 0 0 0 19 40 1 0 0 0 0 19 41 1 0 0 0 0 19 50 1 0 0 0 0 20 21 1 0 0 0 0 20 42 1 0 0 0 0 20 43 1 0 0 0 0 21 22 1 0 0 0 0 21 44 1 0 0 0 0 21 45 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 22 47 1 0 0 0 0 23 48 1 0 0 0 0 23 49 1 0 0 0 0 23 50 1 0 0 0 0 24 25 3 0 0 0 0 50 51 1 0 0 0 0 M CHG 1 50 1 M END