IBS-ZINC04904022 MOE2007 3D CORINA 3.40 0006 02.08.2006 47 50 0 0 1 0 0 0 0 0999 V2000 -0.0180 1.5030 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 0.0230 -0.6990 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0420 -2.0780 1.1990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0390 -2.7730 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0180 -2.0650 -1.2170 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0060 -0.6860 -1.2020 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -4.2490 -0.0210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -5.0380 -1.1340 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0830 -6.3680 -0.6960 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0970 -6.3320 0.6840 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0880 -5.0400 1.0690 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1220 -7.4580 1.5450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -7.2880 2.8430 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -8.3130 3.6270 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1660 -8.1420 4.9330 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1550 -6.9440 5.5930 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1680 -6.9090 6.9150 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1590 -5.8740 7.5460 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1940 -8.2700 7.5700 C 0 0 3 0 0 0 0 0 0 0 0 0 1.0980 -8.3920 8.1670 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1900 -9.4240 6.1580 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.0520 -8.4760 8.4350 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9420 -9.7860 9.1720 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.3500 -9.8290 10.4200 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2490 -11.0310 11.0960 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.7400 -12.1900 10.5230 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.3320 -12.1460 9.2740 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4370 -10.9430 8.6010 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0040 1.8800 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5460 1.8640 -0.8730 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5290 1.8540 0.9070 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0250 -0.1600 2.1340 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0590 -2.6190 2.1330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0160 -2.5960 -2.1580 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1370 -2.1320 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0440 -4.7000 -2.1600 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0890 -7.2510 -1.3180 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1320 -8.4550 1.1300 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1390 -6.1160 5.0890 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1330 -7.6600 9.1540 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9370 -8.4890 7.8000 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0330 -8.9240 10.8680 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2140 -11.0650 12.0710 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6600 -13.1290 11.0500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7150 -13.0510 8.8260 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9030 -10.9090 7.6270 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 30 1 0 0 0 0 1 31 1 0 0 0 0 1 32 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 33 1 0 0 0 0 4 5 1 0 0 0 0 4 34 1 0 0 0 0 5 6 2 0 0 0 0 5 8 1 0 0 0 0 6 7 1 0 0 0 0 6 35 1 0 0 0 0 7 36 1 0 0 0 0 8 9 2 0 0 0 0 8 12 1 0 0 0 0 9 10 1 0 0 0 0 9 37 1 0 0 0 0 10 11 2 0 0 0 0 10 38 1 0 0 0 0 11 12 1 0 0 0 0 11 13 1 0 0 0 0 13 14 2 0 0 0 0 13 39 1 0 0 0 0 14 15 1 0 0 0 0 15 16 2 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 40 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 20 22 1 0 0 0 0 20 23 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 29 2 0 0 0 0 25 26 2 0 0 0 0 25 43 1 0 0 0 0 26 27 1 0 0 0 0 26 44 1 0 0 0 0 27 28 2 0 0 0 0 27 45 1 0 0 0 0 28 29 1 0 0 0 0 28 46 1 0 0 0 0 29 47 1 0 0 0 0 M END