IFLAB-ZINC05267735 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 53 0 0 1 0 0 0 0 0999 V2000 -0.0170 1.4100 0.0100 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0020 -0.0040 0.0020 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2950 -0.3760 -0.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 2.0550 0.7310 -0.0140 O 0 0 0 0 0 0 0 0 0 0 0 0 1.2650 1.8170 0.0000 C 0 0 0 0 0 0 0 0 0 0 0 0 1.8030 -1.7950 -0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0 1.9550 -2.2480 -1.4090 N 0 0 0 0 0 0 0 0 0 0 0 0 3.1410 -2.0570 -2.0590 C 0 0 0 0 0 0 0 0 0 0 0 0 3.2670 -2.4790 -3.3370 C 0 0 0 0 0 0 0 0 0 0 0 0 2.1670 -3.1070 -3.9620 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0340 -3.2700 -3.2900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.9270 -2.8530 -2.0300 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.1230 -3.0180 -1.4310 O 0 0 0 0 0 0 0 0 0 0 0 0 2.2970 -3.6690 -5.6270 S 0 0 0 0 0 0 0 0 0 0 0 0 0.6380 -4.3540 -5.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 0.5140 -4.9100 -7.2530 C 0 0 0 0 0 0 0 0 0 0 0 0 1.4540 -4.8490 -8.0160 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.6430 -5.4750 -7.6530 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.7630 -6.0160 -9.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1660 -6.5950 -9.2040 C 0 0 3 0 0 0 0 0 0 0 0 0 -2.3870 -7.3230 -8.4240 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.2880 -7.2480 -10.5990 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.7290 -6.9120 -11.0460 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.3060 -6.0950 -9.8680 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1510 -5.5390 -9.2010 O 0 0 0 0 0 0 0 0 0 0 0 0 4.6520 -2.1690 -3.8580 C 0 0 0 0 0 0 0 0 0 0 0 0 5.5000 -1.8890 -2.5970 C 0 0 0 0 0 0 0 0 0 0 0 0 4.4290 -1.4190 -1.5890 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8930 2.0410 0.0180 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.8560 -0.6590 0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6020 2.8430 0.0020 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7690 -1.8390 0.4800 H 0 0 0 0 0 0 0 0 0 0 0 0 1.0930 -2.4400 0.4930 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4700 -5.1510 -5.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.1030 -3.5680 -5.7120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.3950 -5.5240 -7.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5950 -5.2190 -9.7340 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0220 -6.8020 -9.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5640 -6.8150 -11.2880 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.1530 -8.3270 -10.5280 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.7160 -6.3120 -11.9560 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3050 -7.8250 -11.1960 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.9510 -5.2980 -10.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.8570 -6.7460 -9.1890 H 0 0 0 0 0 0 0 0 0 0 0 0 5.0530 -3.0250 -4.4010 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6270 -1.2890 -4.5000 H 0 0 0 0 0 0 0 0 0 0 0 0 5.9910 -2.7980 -2.2480 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2300 -1.1020 -2.7860 H 0 0 0 0 0 0 0 0 0 0 0 0 4.3430 -0.3320 -1.6080 H 0 0 0 0 0 0 0 0 0 0 0 0 4.6780 -1.7620 -0.5850 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 5 2 0 0 0 0 1 29 1 0 0 0 0 2 3 2 0 0 0 0 2 30 1 0 0 0 0 3 4 1 0 0 0 0 3 6 1 0 0 0 0 4 5 1 0 0 0 0 5 31 1 0 0 0 0 6 7 1 0 0 0 0 6 32 1 0 0 0 0 6 33 1 0 0 0 0 7 8 1 0 0 0 0 7 12 1 0 0 0 0 8 9 2 0 0 0 0 8 28 1 0 0 0 0 9 10 1 0 0 0 0 9 26 1 0 0 0 0 10 11 2 0 0 0 0 10 14 1 0 0 0 0 11 12 1 0 0 0 0 12 13 2 0 0 0 0 14 15 1 0 0 0 0 15 16 1 0 0 0 0 15 34 1 0 0 0 0 15 35 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 18 19 1 0 0 0 0 18 36 1 0 0 0 0 19 20 1 0 0 0 0 19 37 1 0 0 0 0 19 38 1 0 0 0 0 20 21 1 0 0 0 0 20 22 1 0 0 0 0 20 25 1 0 0 0 0 22 23 1 0 0 0 0 22 39 1 0 0 0 0 22 40 1 0 0 0 0 23 24 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 24 25 1 0 0 0 0 24 43 1 0 0 0 0 24 44 1 0 0 0 0 26 27 1 0 0 0 0 26 45 1 0 0 0 0 26 46 1 0 0 0 0 27 28 1 0 0 0 0 27 47 1 0 0 0 0 27 48 1 0 0 0 0 28 49 1 0 0 0 0 28 50 1 0 0 0 0 M END