IBS-ZINC00495379 MOE2007 3D CORINA 3.40 0006 02.08.2006 35 35 0 0 1 0 0 0 0 0999 V2000 -4.2810 -0.0960 1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8540 0.4570 1.0480 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.7680 -0.6880 0.1540 S 0 0 0 0 0 0 0 0 0 0 0 0 -2.2620 -0.3270 -1.8760 P 0 0 0 0 0 0 0 0 0 0 0 0 -3.7210 -0.4910 -2.0650 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7790 1.3720 -2.3260 C 0 0 3 0 0 0 0 0 0 0 0 0 -0.7280 1.5280 -2.0830 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.9890 1.5800 -3.8040 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.7520 0.6810 -4.5260 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.9450 0.8710 -5.8810 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.3740 1.9600 -6.5150 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.6120 2.8580 -5.7920 C 0 0 0 0 0 0 0 0 0 0 0 0 -1.4230 2.6700 -4.4360 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.6100 3.6350 -3.6610 N 0 3 0 0 0 0 0 0 0 0 0 0 -0.1120 4.5970 -4.2180 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.4410 3.4680 -2.4670 O 0 5 0 0 0 0 0 0 0 0 0 0 -2.5800 2.3040 -1.5960 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.2290 -1.7060 -3.1110 S 0 0 0 0 0 0 0 0 0 0 0 0 -1.8320 -3.3120 -2.5220 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.2570 -3.5400 -3.0310 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.9140 0.5440 1.6740 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.6680 -0.1230 0.0420 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.2750 -1.1050 1.4730 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.8460 1.4280 0.5530 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5000 0.5690 2.0730 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.1980 -0.1690 -4.0310 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5410 0.1690 -6.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.5240 2.1080 -7.5740 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1660 3.7080 -6.2870 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.5320 2.1750 -1.7050 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1820 -4.1030 -2.8950 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.8300 -3.3240 -1.4320 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.9070 -2.7490 -2.6580 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.2590 -3.5290 -4.1210 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.6190 -4.5060 -2.6770 H 0 0 0 0 0 0 0 0 0 0 0 0 1 2 1 0 0 0 0 1 21 1 0 0 0 0 1 22 1 0 0 0 0 1 23 1 0 0 0 0 2 3 1 0 0 0 0 2 24 1 0 0 0 0 2 25 1 0 0 0 0 3 4 1 0 0 0 0 4 5 2 0 0 0 0 4 6 1 0 0 0 0 4 18 1 0 0 0 0 6 7 1 0 0 0 0 6 8 1 0 0 0 0 6 17 1 0 0 0 0 8 9 1 0 0 0 0 8 13 2 0 0 0 0 9 10 2 0 0 0 0 9 26 1 0 0 0 0 10 11 1 0 0 0 0 10 27 1 0 0 0 0 11 12 2 0 0 0 0 11 28 1 0 0 0 0 12 13 1 0 0 0 0 12 29 1 0 0 0 0 13 14 1 0 0 0 0 14 15 2 0 0 0 0 14 16 1 0 0 0 0 17 30 1 0 0 0 0 18 19 1 0 0 0 0 19 20 1 0 0 0 0 19 31 1 0 0 0 0 19 32 1 0 0 0 0 20 33 1 0 0 0 0 20 34 1 0 0 0 0 20 35 1 0 0 0 0 M CHG 1 14 1 M CHG 1 16 -1 M END