ENAMINE-ZINC05688362 MOE2007 3D CORINA 3.40 0006 02.08.2006 50 52 0 0 0 0 0 0 0 0999 V2000 -0.4540 2.8620 -0.3780 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2240 2.3570 2.0710 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.9280 2.4270 3.4370 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.2300 1.7160 3.3480 N 0 0 0 0 0 0 0 0 0 0 0 0 -3.1450 2.3250 2.3500 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.4890 2.2540 0.9600 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.8800 0.9820 4.7340 S 0 0 0 0 0 0 0 0 0 0 0 0 -4.0440 0.2190 4.3330 O 0 0 0 0 0 0 0 0 0 0 0 0 -1.7970 0.3500 5.4610 O 0 0 0 0 0 0 0 0 0 0 0 0 -3.4530 2.3390 5.7280 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.7930 2.7150 5.6790 C 0 0 0 0 0 0 0 0 0 0 0 0 -5.2830 3.6790 6.5730 C 0 0 0 0 0 0 0 0 0 0 0 0 -4.4680 4.2800 7.5480 C 0 0 0 0 0 0 0 0 0 0 0 0 -3.1070 3.8890 7.5530 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.6000 2.9190 6.6640 C 0 0 0 0 0 0 0 0 0 0 0 0 -2.1550 4.4940 8.4950 N 0 3 0 0 0 0 0 0 0 0 0 0 -2.5960 4.9710 9.5520 O 0 0 0 0 0 0 0 0 0 0 0 0 -0.9600 4.4990 8.1640 O 0 5 0 0 0 0 0 0 0 0 0 0 -4.9700 5.2080 8.4470 N 0 0 0 0 0 0 0 0 0 0 0 0 -6.3180 5.7610 8.4630 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.3450 7.0520 9.2840 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.4570 6.6050 10.7410 C 0 0 0 0 0 0 0 0 0 0 0 0 -6.9890 5.1730 10.7100 C 0 0 0 0 0 0 0 0 0 0 0 0 -7.2730 4.8620 9.2430 C 0 0 0 0 0 0 0 0 0 0 0 0 -0.2820 1.8130 -0.6330 H 0 0 0 0 0 0 0 0 0 0 0 0 0.4890 3.4110 -0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 3.3380 -1.1030 H 0 0 0 0 0 0 0 0 0 0 0 0 0.6970 2.9490 2.0770 H 0 0 0 0 0 0 0 0 0 0 0 0 0.0010 1.3200 1.7940 H 0 0 0 0 0 0 0 0 0 0 0 0 -0.2790 1.9600 4.1840 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.0950 3.4690 3.7310 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.0960 1.7860 2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.3520 3.3660 2.6250 H 0 0 0 0 0 0 0 0 0 0 0 0 -2.3320 1.2150 0.6490 H 0 0 0 0 0 0 0 0 0 0 0 0 -3.0980 2.7760 0.2150 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4830 2.2460 4.9790 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.3410 3.9240 6.5120 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.5600 2.6010 6.7220 H 0 0 0 0 0 0 0 0 0 0 0 0 -4.3370 5.5100 9.1950 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.6670 5.9650 7.4460 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4690 7.6890 9.1200 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.2360 7.6350 9.0200 H 0 0 0 0 0 0 0 0 0 0 0 0 -5.4770 6.6290 11.2300 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1200 7.2700 11.3050 H 0 0 0 0 0 0 0 0 0 0 0 0 -6.2290 4.4870 11.1020 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.8860 5.0550 11.3270 H 0 0 0 0 0 0 0 0 0 0 0 0 -8.3090 5.1360 9.0090 H 0 0 0 0 0 0 0 0 0 0 0 0 -7.1540 3.7960 9.0270 H 0 0 0 0 0 0 0 0 0 0 0 0 -1.1180 2.9260 0.9710 N 0 3 0 0 0 0 0 0 0 0 0 0 -1.2640 3.9230 1.1810 H 0 0 0 0 0 0 0 0 0 0 0 0 1 25 1 0 0 0 0 1 26 1 0 0 0 0 1 27 1 0 0 0 0 1 49 1 0 0 0 0 2 3 1 0 0 0 0 2 28 1 0 0 0 0 2 29 1 0 0 0 0 2 49 1 0 0 0 0 3 4 1 0 0 0 0 3 30 1 0 0 0 0 3 31 1 0 0 0 0 4 5 1 0 0 0 0 4 7 1 0 0 0 0 5 6 1 0 0 0 0 5 32 1 0 0 0 0 5 33 1 0 0 0 0 6 34 1 0 0 0 0 6 35 1 0 0 0 0 6 49 1 0 0 0 0 7 8 2 0 0 0 0 7 9 2 0 0 0 0 7 10 1 0 0 0 0 10 11 1 0 0 0 0 10 15 2 0 0 0 0 11 12 2 0 0 0 0 11 36 1 0 0 0 0 12 13 1 0 0 0 0 12 37 1 0 0 0 0 13 14 2 0 0 0 0 13 19 1 0 0 0 0 14 15 1 0 0 0 0 14 16 1 0 0 0 0 15 38 1 0 0 0 0 16 17 2 0 0 0 0 16 18 1 0 0 0 0 19 20 1 0 0 0 0 19 39 1 0 0 0 0 20 21 1 0 0 0 0 20 24 1 0 0 0 0 20 40 1 0 0 0 0 21 22 1 0 0 0 0 21 41 1 0 0 0 0 21 42 1 0 0 0 0 22 23 1 0 0 0 0 22 43 1 0 0 0 0 22 44 1 0 0 0 0 23 24 1 0 0 0 0 23 45 1 0 0 0 0 23 46 1 0 0 0 0 24 47 1 0 0 0 0 24 48 1 0 0 0 0 49 50 1 0 0 0 0 M CHG 1 16 1 M CHG 1 18 -1 M CHG 1 49 1 M END