IBS-ZINC02411568 MOE2007 3D CORINA 3.40 0006 02.08.2006 44 44 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 -0.8690 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 4.3550 0.9610 0.0000 O 0 0 0 0 0 0 0 0 0 0 0 0 3.7010 3.0250 -0.4960 N 0 0 0 0 0 0 0 0 0 0 0 0 4.8960 3.6000 0.1270 C 0 0 0 0 0 0 0 0 0 0 0 0 4.8540 5.1010 0.0050 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2560 5.8580 0.9950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.2170 7.2360 0.8840 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7750 7.8560 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0 5.3730 7.0990 -1.2080 C 0 0 0 0 0 0 0 0 0 0 0 0 5.4160 5.7220 -1.0950 C 0 0 0 0 0 0 0 0 0 0 0 0 4.7240 9.6110 -0.3610 S 0 0 0 0 0 0 0 0 0 0 0 0 4.8390 9.9050 -1.7470 O 0 0 0 0 0 0 0 0 0 0 0 0 3.6320 10.0470 0.4370 O 0 0 0 0 0 0 0 0 0 0 0 0 6.0940 10.2020 0.3580 N 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 0.0080 0.8040 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2370 0.9700 0.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 0.2760 -1.9280 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 3.0380 3.6060 -0.9000 H 0 0 0 0 0 0 0 0 0 0 0 0 4.9270 3.3220 1.1800 H 0 0 0 0 0 0 0 0 0 0 0 0 5.7860 3.2200 -0.3760 H 0 0 0 0 0 0 0 0 0 0 0 0 3.8200 5.3740 1.8560 H 0 0 0 0 0 0 0 0 0 0 0 0 3.7500 7.8270 1.6570 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8090 7.5840 -2.0700 H 0 0 0 0 0 0 0 0 0 0 0 0 5.8870 5.1310 -1.8660 H 0 0 0 0 0 0 0 0 0 0 0 0 6.7360 9.5920 0.7520 H 0 0 0 0 0 0 0 0 0 0 0 0 6.2540 11.1580 0.3840 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 3.3960 -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 24 1 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 2 3 1 0 0 0 0 2 4 1 0 0 0 0 2 27 1 0 0 0 0 3 28 1 0 0 0 0 3 29 1 0 0 0 0 3 30 1 0 0 0 0 4 5 1 0 0 0 0 4 31 1 0 0 0 0 4 32 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 43 1 0 0 0 0 9 10 1 0 0 0 0 9 33 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 34 1 0 0 0 0 13 14 1 0 0 0 0 13 35 1 0 0 0 0 13 36 1 0 0 0 0 14 15 1 0 0 0 0 14 19 2 0 0 0 0 15 16 2 0 0 0 0 15 37 1 0 0 0 0 16 17 1 0 0 0 0 16 38 1 0 0 0 0 17 18 2 0 0 0 0 17 20 1 0 0 0 0 18 19 1 0 0 0 0 18 39 1 0 0 0 0 19 40 1 0 0 0 0 20 21 2 0 0 0 0 20 22 2 0 0 0 0 20 23 1 0 0 0 0 23 41 1 0 0 0 0 23 42 1 0 0 0 0 43 44 1 0 0 0 0 M END