IBS-ZINC00957903 MOE2007 3D CORINA 3.40 0006 02.08.2006 53 55 0 0 0 0 0 0 0 0999 V2000 0.0050 1.5050 0.0090 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0280 -0.0020 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0600 -0.7520 1.1760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -2.1310 0.9440 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1090 -2.9800 1.9900 N 0 0 0 0 0 0 0 0 0 0 0 0 0.1240 -2.5650 3.2210 C 0 0 0 0 0 0 0 0 0 0 0 0 0.1080 -1.2490 3.5480 N 0 0 0 0 0 0 0 0 0 0 0 0 0.0780 -0.3060 2.5850 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0640 0.8790 2.8680 O 0 0 0 0 0 0 0 0 0 0 0 0 0.1260 -0.8500 4.9580 C 0 0 0 0 0 0 0 0 0 0 0 0 1.5520 -0.6910 5.4180 C 0 0 0 0 0 0 0 0 0 0 0 0 2.4610 -0.8910 4.6470 O 0 0 0 0 0 0 0 0 0 0 0 0 1.8130 -0.3270 6.6830 O 0 0 0 0 0 0 0 0 0 0 0 0 3.2100 -0.1930 7.0560 C 0 0 0 0 0 0 0 0 0 0 0 0 3.3080 0.2250 8.5240 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7770 0.2450 8.9520 C 0 0 0 0 0 0 0 0 0 0 0 0 2.7070 1.6210 8.6990 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0530 -2.4330 -0.7890 S 0 0 0 0 0 0 0 0 0 0 0 0 0.0140 -0.7130 -1.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0260 -0.1330 -2.4830 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.0480 1.0750 -2.6250 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.0370 -0.9390 -3.5640 N 0 0 0 0 0 0 0 0 0 0 0 0 -0.1690 -0.3900 -4.8450 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4000 0.8410 -5.1370 C 0 0 0 0 0 0 0 0 0 0 0 0 0.2680 1.3810 -6.4020 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.4300 0.6970 -7.3800 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.0010 -0.5310 -7.0970 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.8680 -1.0820 -5.8320 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 -2.2910 -5.5540 O 0 0 0 0 0 0 0 0 0 0 0 0 -2.1250 -2.9420 -6.6150 C 0 0 0 0 0 0 0 0 0 0 0 0 1.0270 1.8840 -0.0070 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5300 1.8640 -0.8700 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4990 1.8560 0.9090 H 0 0 0 0 0 0 0 0 0 0 0 0 0.1480 -3.2970 4.0140 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.4010 0.0980 5.0740 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.3660 -1.6150 5.5580 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7160 -1.1480 6.9150 H 0 0 0 0 0 0 0 0 0 0 0 0 3.6820 0.5640 6.4300 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7590 -0.4870 9.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3250 0.9560 8.3340 H 0 0 0 0 0 0 0 0 0 0 0 0 4.8470 0.5420 9.9980 H 0 0 0 0 0 0 0 0 0 0 0 0 5.2050 -0.7500 8.8280 H 0 0 0 0 0 0 0 0 0 0 0 0 3.2550 2.3320 8.0810 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6600 1.6060 8.3940 H 0 0 0 0 0 0 0 0 0 0 0 0 2.7770 1.9180 9.7450 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0460 -1.8990 -3.4540 H 0 0 0 0 0 0 0 0 0 0 0 0 0.9450 1.3780 -4.3750 H 0 0 0 0 0 0 0 0 0 0 0 0 0.7110 2.3400 -6.6280 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.5310 1.1220 -8.3670 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5460 -1.0620 -7.8630 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.9490 -2.3110 -6.9470 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.4430 -3.1170 -7.4480 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5170 -3.8960 -6.2600 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 31 1 0 0 0 0 1 32 1 0 0 0 0 1 33 1 0 0 0 0 2 3 1 0 0 0 0 2 19 2 0 0 0 0 3 4 2 0 0 0 0 3 8 1 0 0 0 0 4 5 1 0 0 0 0 4 18 1 0 0 0 0 5 6 2 0 0 0 0 6 7 1 0 0 0 0 6 34 1 0 0 0 0 7 8 1 0 0 0 0 7 10 1 0 0 0 0 8 9 2 0 0 0 0 10 11 1 0 0 0 0 10 35 1 0 0 0 0 10 36 1 0 0 0 0 11 12 2 0 0 0 0 11 13 1 0 0 0 0 13 14 1 0 0 0 0 14 15 1 0 0 0 0 14 37 1 0 0 0 0 14 38 1 0 0 0 0 15 16 1 0 0 0 0 15 17 1 0 0 0 0 15 39 1 0 0 0 0 16 40 1 0 0 0 0 16 41 1 0 0 0 0 16 42 1 0 0 0 0 17 43 1 0 0 0 0 17 44 1 0 0 0 0 17 45 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 20 21 2 0 0 0 0 20 22 1 0 0 0 0 22 23 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 28 2 0 0 0 0 24 25 2 0 0 0 0 24 47 1 0 0 0 0 25 26 1 0 0 0 0 25 48 1 0 0 0 0 26 27 2 0 0 0 0 26 49 1 0 0 0 0 27 28 1 0 0 0 0 27 50 1 0 0 0 0 28 29 1 0 0 0 0 29 30 1 0 0 0 0 30 51 1 0 0 0 0 30 52 1 0 0 0 0 30 53 1 0 0 0 0 M END