IBS-ZINC04083637 MOE2007 3D CORINA 3.40 0006 02.08.2006 56 56 0 0 1 0 0 0 0 0999 V2000 -1.4920 -0.2800 -0.1170 C 0 0 0 0 0 0 0 0 0 0 0 0 0.0170 -0.0900 0.0500 C 0 0 0 0 0 0 0 0 0 0 0 0 0.4960 -0.8700 1.2760 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7370 -0.6070 -1.1970 C 0 0 0 0 0 0 0 0 0 0 0 0 2.2300 -0.2920 -1.0910 C 0 0 3 0 0 0 0 0 0 0 0 0 2.6270 -0.7190 -0.1700 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9540 -0.8850 -2.2720 C 0 0 0 0 0 0 0 0 0 0 0 0 3.5690 -0.1690 -3.0260 O 0 0 0 0 0 0 0 0 0 0 0 0 2.4240 1.1600 -1.0790 N 0 0 0 0 0 0 0 0 0 0 0 0 3.5230 1.6890 -0.5060 C 0 0 0 0 0 0 0 0 0 0 0 0 4.3530 0.9630 -0.0010 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7220 3.1830 -0.4940 C 0 0 0 0 0 0 0 0 0 0 0 0 5.0390 3.5160 0.2110 C 0 0 0 0 0 0 0 0 0 0 0 0 5.2550 5.0330 0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0 4.0750 5.6860 0.7750 N 0 0 0 0 0 0 0 0 0 0 0 0 2.7480 5.3660 0.2310 C 0 0 0 0 0 0 0 0 0 0 0 0 2.5610 3.8460 0.2500 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2080 6.5620 1.7910 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3080 6.8170 2.2320 O 0 0 0 0 0 0 0 0 0 0 0 0 2.9880 7.2230 2.3790 C 0 0 3 0 0 0 0 0 0 0 0 0 2.1780 6.4970 2.4470 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5570 8.3860 1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0 1.2490 8.9790 2.0120 C 0 0 0 0 0 0 0 0 0 0 0 0 0.7380 10.3580 0.9500 S 0 0 0 0 0 0 0 0 0 0 0 0 -0.8030 10.9200 1.7250 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.8480 0.3440 -0.9370 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.7040 -1.3260 -0.3380 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9990 0.0070 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 0.9690 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -1.9290 1.1420 H 0 0 0 0 0 0 0 0 0 0 0 0 1.5710 -0.7340 1.3950 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.0170 -0.5010 2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0 0.5980 -1.6850 -1.2760 H 0 0 0 0 0 0 0 0 0 0 0 0 0.3250 -0.1210 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0 1.7600 1.7410 -1.4830 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7550 3.5530 -1.5190 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9970 3.1680 1.2430 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8630 3.0250 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0 6.1390 5.2840 0.7760 H 0 0 0 0 0 0 0 0 0 0 0 0 5.3870 5.3700 -0.8370 H 0 0 0 0 0 0 0 0 0 0 0 0 1.9790 5.8370 0.8420 H 0 0 0 0 0 0 0 0 0 0 0 0 2.6770 5.7300 -0.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 1.6210 3.5890 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0 2.5420 3.4950 1.2820 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3310 9.1540 1.4870 H 0 0 0 0 0 0 0 0 0 0 0 0 2.4070 8.0250 0.4660 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4750 8.2120 2.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 1.3990 9.3400 3.0300 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5260 10.1040 1.7290 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.6020 11.2320 2.7500 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.2080 11.7610 1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0 4.0540 8.4050 3.6850 H 0 0 0 0 0 0 0 0 0 0 0 0 2.9170 -2.2100 -2.4860 O 0 0 0 0 0 0 0 0 0 0 0 0 3.3060 7.7300 3.7210 N 0 0 0 0 0 0 0 0 0 0 0 0 2.4870 8.1210 4.1630 H 0 0 0 0 0 0 0 0 0 0 0 0 3.3960 -2.5440 -3.2560 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 4 1 0 0 0 0 2 29 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 3 32 1 0 0 0 0 4 5 1 0 0 0 0 4 33 1 0 0 0 0 4 34 1 0 0 0 0 5 6 1 0 0 0 0 5 7 1 0 0 0 0 5 9 1 0 0 0 0 7 8 2 0 0 0 0 7 53 1 0 0 0 0 9 10 1 0 0 0 0 9 35 1 0 0 0 0 10 11 2 0 0 0 0 10 12 1 0 0 0 0 12 13 1 0 0 0 0 12 17 1 0 0 0 0 12 36 1 0 0 0 0 13 14 1 0 0 0 0 13 37 1 0 0 0 0 13 38 1 0 0 0 0 14 15 1 0 0 0 0 14 39 1 0 0 0 0 14 40 1 0 0 0 0 15 16 1 0 0 0 0 15 18 1 0 0 0 0 16 17 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 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 54 1 0 0 0 0 22 23 1 0 0 0 0 22 45 1 0 0 0 0 22 46 1 0 0 0 0 23 24 1 0 0 0 0 23 47 1 0 0 0 0 23 48 1 0 0 0 0 24 25 1 0 0 0 0 25 49 1 0 0 0 0 25 50 1 0 0 0 0 25 51 1 0 0 0 0 52 54 1 0 0 0 0 53 56 1 0 0 0 0 54 55 1 0 0 0 0 M END